HEADER INTEGRASE/DNA 21-JAN-99 1B69 TITLE THE SOLUTION STRUCTURE OF TN916 INTEGRASE N-TERMINAL TITLE 2 DOMAIN/DNA COMPLEX COMPND MOL_ID: 1; COMPND 2 MOLECULE: PROTEIN (INTEGRASE); COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: N-TERMINAL DNA BINDING DOMAIN; COMPND 5 ENGINEERED: YES; COMPND 6 MUTATION: YES; COMPND 7 MOL_ID: 2; COMPND 8 MOLECULE: DNA (5'- COMPND 9 D(*GP*AP*GP*TP*AP*GP*TP*AP*AP*AP*TP*TP*C)-3'); COMPND 10 CHAIN: B; COMPND 11 ENGINEERED: YES; COMPND 12 MOL_ID: 3; COMPND 13 MOLECULE: DNA (5'- COMPND 14 D(*GP*AP*AP*TP*TP*TP*AP*CP*TP*AP*CP*TP*C)-3'); COMPND 15 CHAIN: C; COMPND 16 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS FAECALIS; SOURCE 3 ORGANISM_TAXID: 1351; SOURCE 4 STRAIN: BL21(DE3); SOURCE 5 CELLULAR_LOCATION: CYTOPLASM; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PET11A; SOURCE 11 MOL_ID: 2; SOURCE 12 SYNTHETIC: YES; SOURCE 13 MOL_ID: 3; SOURCE 14 SYNTHETIC: YES KEYWDS INTEGRASE, DNA BINDING, TRANSPOSITION, COMPLEX, BETA-SHEET KEYWDS 2 RECOGNITION, INTEGRASE/DNA COMPLEX EXPDTA SOLUTION NMR AUTHOR R.T.CLUBB,J.M.WOJCIAK,K.M.CONNOLLY REVDAT 4 24-FEB-09 1B69 1 VERSN REVDAT 3 01-APR-03 1B69 1 JRNL REVDAT 2 28-OCT-99 1B69 1 HELIX REVDAT 1 29-SEP-99 1B69 0 JRNL AUTH J.M.WOJCIAK,K.M.CONNOLLY,R.T.CLUBB JRNL TITL NMR STRUCTURE OF THE TN916 INTEGRASE-DNA COMPLEX. JRNL REF NAT.STRUCT.BIOL. V. 6 366 1999 JRNL REFN ISSN 1072-8368 JRNL PMID 10201406 JRNL DOI 10.1038/7603 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.843 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1B69 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 22-JUL-99. REMARK 100 THE RCSB ID CODE IS RCSB007237. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 305 REMARK 210 PH : 6.0 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : NOESY ETC. REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ, 600 MHZ REMARK 210 SPECTROMETER MODEL : DRX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : X-PLOR REMARK 210 METHOD USED : DISTANCE GEOMETRY AND REMARK 210 SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 100 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : LEAST RESTRAINT VIOLATION REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: THREE AND FOUR-DIMENSIONAL HETERONUCLEAR NMR EXPERIMENTS REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION REMARK 500 DT C 125 C5 DT C 125 C7 0.036 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 DG B 101 O4' - C1' - N9 ANGL. DEV. = 3.5 DEGREES REMARK 500 DA B 102 O4' - C1' - N9 ANGL. DEV. = 2.4 DEGREES REMARK 500 DG B 103 O4' - C1' - N9 ANGL. DEV. = 3.3 DEGREES REMARK 500 DT B 104 O4' - C1' - N1 ANGL. DEV. = 2.2 DEGREES REMARK 500 DA B 105 O4' - C1' - N9 ANGL. DEV. = 2.8 DEGREES REMARK 500 DG B 106 O4' - C1' - N9 ANGL. DEV. = 3.3 DEGREES REMARK 500 DT B 107 O4' - C1' - N1 ANGL. DEV. = 2.8 DEGREES REMARK 500 DA B 108 O4' - C1' - N9 ANGL. DEV. = 2.4 DEGREES REMARK 500 DA B 109 O4' - C1' - N9 ANGL. DEV. = 2.9 DEGREES REMARK 500 DA B 110 O4' - C1' - N9 ANGL. DEV. = 2.7 DEGREES REMARK 500 DT B 111 O4' - C1' - N1 ANGL. DEV. = 2.8 DEGREES REMARK 500 DT B 112 O4' - C1' - N1 ANGL. DEV. = 2.2 DEGREES REMARK 500 DC B 113 O4' - C1' - N1 ANGL. DEV. = 2.1 DEGREES REMARK 500 DG C 114 O4' - C1' - N9 ANGL. DEV. = 2.1 DEGREES REMARK 500 DA C 115 O4' - C1' - N9 ANGL. DEV. = 2.4 DEGREES REMARK 500 DA C 116 O4' - C1' - N9 ANGL. DEV. = 3.4 DEGREES REMARK 500 DT C 117 O4' - C1' - N1 ANGL. DEV. = 3.0 DEGREES REMARK 500 DT C 118 O4' - C1' - N1 ANGL. DEV. = 2.0 DEGREES REMARK 500 DT C 119 O4' - C1' - N1 ANGL. DEV. = 2.4 DEGREES REMARK 500 DA C 120 O4' - C1' - N9 ANGL. DEV. = 2.4 DEGREES REMARK 500 DC C 121 O4' - C1' - N1 ANGL. DEV. = 2.0 DEGREES REMARK 500 DT C 122 O4' - C1' - N1 ANGL. DEV. = 2.6 DEGREES REMARK 500 DT C 122 C6 - C5 - C7 ANGL. DEV. = -3.7 DEGREES REMARK 500 DA C 123 O4' - C1' - N9 ANGL. DEV. = 2.5 DEGREES REMARK 500 DC C 124 O4' - C1' - N1 ANGL. DEV. = 3.0 DEGREES REMARK 500 DT C 125 O4' - C1' - N1 ANGL. DEV. = 2.9 DEGREES REMARK 500 DC C 126 O4' - C1' - N1 ANGL. DEV. = 2.4 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ARG A 9 -108.02 -104.99 REMARK 500 THR A 15 162.79 -46.76 REMARK 500 SER A 18 -162.84 -176.07 REMARK 500 ARG A 20 -154.16 -84.65 REMARK 500 SER A 32 11.66 -66.56 REMARK 500 PRO A 36 151.92 -42.80 REMARK 500 ALA A 46 65.70 -69.42 REMARK 500 THR A 47 -31.56 -151.78 REMARK 500 ASP A 48 -164.11 -68.14 REMARK 500 LYS A 69 -94.59 -74.50 REMARK 500 ASP A 70 -44.59 -157.23 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1TN9 RELATED DB: PDB REMARK 900 20 STRUCTURES DBREF 1B69 A 3 71 UNP P22886 TNR6_ENTFA 3 71 DBREF 1B69 B 101 113 PDB 1B69 1B69 101 113 DBREF 1B69 C 114 126 PDB 1B69 1B69 114 126 SEQADV 1B69 ALA A 57 UNP P22886 CYS 57 MUTATION SEQRES 1 A 69 GLU LYS ARG ARG ASP ASN ARG GLY ARG ILE LEU LYS THR SEQRES 2 A 69 GLY GLU SER GLN ARG LYS ASP GLY ARG TYR LEU TYR LYS SEQRES 3 A 69 TYR ILE ASP SER PHE GLY GLU PRO GLN PHE VAL TYR SER SEQRES 4 A 69 TRP LYS LEU VAL ALA THR ASP ARG VAL PRO ALA GLY LYS SEQRES 5 A 69 ARG ASP ALA ILE SER LEU ARG GLU LYS ILE ALA GLU LEU SEQRES 6 A 69 GLN LYS ASP ILE SEQRES 1 B 13 DG DA DG DT DA DG DT DA DA DA DT DT DC SEQRES 1 C 13 DG DA DA DT DT DT DA DC DT DA DC DT DC HELIX 1 1 SER A 59 LYS A 69 1 11 SHEET 1 A 3 GLU A 17 GLN A 19 0 SHEET 2 A 3 TYR A 25 ILE A 30 0 SHEET 3 A 3 PRO A 36 SER A 41 0 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 ATOM 1 N GLU A 3 16.094 -13.192 10.706 1.00 3.25 N ATOM 2 CA GLU A 3 16.125 -11.804 10.164 1.00 2.61 C ATOM 3 C GLU A 3 14.801 -11.103 10.466 1.00 2.05 C ATOM 4 O GLU A 3 13.743 -11.579 10.104 1.00 2.37 O ATOM 5 CB GLU A 3 16.330 -11.850 8.647 1.00 3.14 C ATOM 6 CG GLU A 3 17.532 -12.735 8.314 1.00 3.72 C ATOM 7 CD GLU A 3 17.671 -12.852 6.796 1.00 4.48 C ATOM 8 OE1 GLU A 3 16.655 -13.002 6.138 1.00 4.94 O ATOM 9 OE2 GLU A 3 18.791 -12.788 6.318 1.00 4.96 O ATOM 10 H GLU A 3 15.257 -13.701 10.700 1.00 3.64 H ATOM 11 HA GLU A 3 16.935 -11.255 10.621 1.00 2.84 H ATOM 12 HB2 GLU A 3 15.444 -12.254 8.179 1.00 3.53 H ATOM 13 HB3 GLU A 3 16.507 -10.850 8.277 1.00 3.38 H ATOM 14 HG2 GLU A 3 18.429 -12.294 8.726 1.00 3.85 H ATOM 15 HG3 GLU A 3 17.386 -13.717 8.738 1.00 3.99 H ATOM 16 N LYS A 4 14.852 -9.967 11.118 1.00 1.75 N ATOM 17 CA LYS A 4 13.599 -9.211 11.442 1.00 1.51 C ATOM 18 C LYS A 4 13.801 -7.746 11.037 1.00 1.34 C ATOM 19 O LYS A 4 14.740 -7.100 11.456 1.00 1.81 O ATOM 20 CB LYS A 4 13.315 -9.298 12.972 1.00 1.74 C ATOM 21 CG LYS A 4 12.058 -10.162 13.290 1.00 1.68 C ATOM 22 CD LYS A 4 12.474 -11.595 13.666 1.00 2.02 C ATOM 23 CE LYS A 4 13.242 -11.605 15.007 1.00 2.03 C ATOM 24 NZ LYS A 4 12.796 -12.773 15.816 1.00 2.64 N ATOM 25 H LYS A 4 15.721 -9.602 11.389 1.00 2.13 H ATOM 26 HA LYS A 4 12.772 -9.613 10.877 1.00 1.76 H ATOM 27 HB2 LYS A 4 14.179 -9.730 13.456 1.00 2.22 H ATOM 28 HB3 LYS A 4 13.163 -8.301 13.373 1.00 2.36 H ATOM 29 HG2 LYS A 4 11.523 -9.722 14.121 1.00 1.98 H ATOM 30 HG3 LYS A 4 11.399 -10.197 12.439 1.00 2.11 H ATOM 31 HD2 LYS A 4 11.588 -12.207 13.759 1.00 2.42 H ATOM 32 HD3 LYS A 4 13.104 -11.999 12.886 1.00 2.40 H ATOM 33 HE2 LYS A 4 14.304 -11.687 14.819 1.00 2.20 H ATOM 34 HE3 LYS A 4 13.049 -10.696 15.560 1.00 2.10 H ATOM 35 HZ1 LYS A 4 12.379 -13.490 15.190 1.00 2.99 H ATOM 36 HZ2 LYS A 4 13.610 -13.182 16.316 1.00 3.02 H ATOM 37 HZ3 LYS A 4 12.084 -12.460 16.509 1.00 2.89 H ATOM 38 N ARG A 5 12.918 -7.211 10.243 1.00 1.21 N ATOM 39 CA ARG A 5 13.058 -5.789 9.840 1.00 1.09 C ATOM 40 C ARG A 5 12.577 -4.916 10.998 1.00 0.93 C ATOM 41 O ARG A 5 11.986 -5.405 11.940 1.00 0.95 O ATOM 42 CB ARG A 5 12.207 -5.522 8.596 1.00 1.24 C ATOM 43 CG ARG A 5 12.867 -6.184 7.382 1.00 1.58 C ATOM 44 CD ARG A 5 11.908 -6.170 6.184 1.00 1.47 C ATOM 45 NE ARG A 5 11.876 -4.811 5.575 1.00 2.25 N ATOM 46 CZ ARG A 5 11.393 -4.651 4.372 1.00 2.83 C ATOM 47 NH1 ARG A 5 10.943 -5.679 3.706 1.00 2.80 N ATOM 48 NH2 ARG A 5 11.359 -3.463 3.836 1.00 3.86 N ATOM 49 H ARG A 5 12.158 -7.741 9.924 1.00 1.59 H ATOM 50 HA ARG A 5 14.095 -5.570 9.627 1.00 1.17 H ATOM 51 HB2 ARG A 5 11.219 -5.933 8.745 1.00 1.71 H ATOM 52 HB3 ARG A 5 12.135 -4.458 8.430 1.00 1.60 H ATOM 53 HG2 ARG A 5 13.769 -5.647 7.128 1.00 2.28 H ATOM 54 HG3 ARG A 5 13.116 -7.206 7.625 1.00 2.19 H ATOM 55 HD2 ARG A 5 12.249 -6.882 5.448 1.00 1.57 H ATOM 56 HD3 ARG A 5 10.916 -6.438 6.509 1.00 1.89 H ATOM 57 HE ARG A 5 12.213 -4.039 6.076 1.00 2.72 H ATOM 58 HH11 ARG A 5 10.967 -6.590 4.116 1.00 2.39 H ATOM 59 HH12 ARG A 5 10.573 -5.555 2.785 1.00 3.49 H ATOM 60 HH21 ARG A 5 11.702 -2.674 4.346 1.00 4.23 H ATOM 61 HH22 ARG A 5 10.988 -3.341 2.916 1.00 4.42 H ATOM 62 N ARG A 6 12.831 -3.634 10.944 1.00 0.86 N ATOM 63 CA ARG A 6 12.396 -2.726 12.052 1.00 0.77 C ATOM 64 C ARG A 6 11.687 -1.505 11.471 1.00 0.73 C ATOM 65 O ARG A 6 11.658 -1.300 10.273 1.00 0.79 O ATOM 66 CB ARG A 6 13.618 -2.250 12.833 1.00 0.90 C ATOM 67 CG ARG A 6 14.446 -3.465 13.324 1.00 1.26 C ATOM 68 CD ARG A 6 15.113 -3.169 14.686 1.00 0.98 C ATOM 69 NE ARG A 6 16.528 -3.627 14.656 1.00 1.69 N ATOM 70 CZ ARG A 6 17.370 -3.186 15.550 1.00 1.92 C ATOM 71 NH1 ARG A 6 16.962 -2.364 16.479 1.00 2.10 N ATOM 72 NH2 ARG A 6 18.617 -3.568 15.518 1.00 2.68 N ATOM 73 H ARG A 6 13.315 -3.267 10.175 1.00 0.95 H ATOM 74 HA ARG A 6 11.730 -3.247 12.731 1.00 0.74 H ATOM 75 HB2 ARG A 6 14.230 -1.627 12.194 1.00 1.23 H ATOM 76 HB3 ARG A 6 13.278 -1.670 13.677 1.00 1.38 H ATOM 77 HG2 ARG A 6 13.801 -4.330 13.423 1.00 1.98 H ATOM 78 HG3 ARG A 6 15.216 -3.686 12.598 1.00 1.94 H ATOM 79 HD2 ARG A 6 15.091 -2.108 14.895 1.00 1.11 H ATOM 80 HD3 ARG A 6 14.589 -3.698 15.467 1.00 1.15 H ATOM 81 HE ARG A 6 16.827 -4.255 13.964 1.00 2.42 H ATOM 82 HH11 ARG A 6 16.005 -2.074 16.505 1.00 2.00 H ATOM 83 HH12 ARG A 6 17.606 -2.026 17.165 1.00 2.76 H ATOM 84 HH21 ARG A 6 18.929 -4.199 14.809 1.00 3.18 H ATOM 85 HH22 ARG A 6 19.260 -3.228 16.205 1.00 3.02 H ATOM 86 N ASP A 7 11.131 -0.680 12.314 1.00 0.67 N ATOM 87 CA ASP A 7 10.441 0.544 11.822 1.00 0.69 C ATOM 88 C ASP A 7 11.481 1.644 11.612 1.00 0.76 C ATOM 89 O ASP A 7 12.668 1.388 11.571 1.00 0.88 O ATOM 90 CB ASP A 7 9.419 1.007 12.861 1.00 0.67 C ATOM 91 CG ASP A 7 10.091 1.084 14.233 1.00 0.86 C ATOM 92 OD1 ASP A 7 11.276 0.802 14.307 1.00 1.38 O ATOM 93 OD2 ASP A 7 9.409 1.422 15.186 1.00 1.56 O ATOM 94 H ASP A 7 11.180 -0.860 13.277 1.00 0.67 H ATOM 95 HA ASP A 7 9.940 0.332 10.888 1.00 0.72 H ATOM 96 HB2 ASP A 7 9.045 1.983 12.586 1.00 0.87 H ATOM 97 HB3 ASP A 7 8.601 0.306 12.903 1.00 0.70 H ATOM 98 N ASN A 8 11.050 2.867 11.485 1.00 0.75 N ATOM 99 CA ASN A 8 12.025 3.979 11.286 1.00 0.82 C ATOM 100 C ASN A 8 12.715 4.294 12.616 1.00 0.83 C ATOM 101 O ASN A 8 13.564 5.160 12.695 1.00 0.94 O ATOM 102 CB ASN A 8 11.291 5.225 10.791 1.00 0.87 C ATOM 103 CG ASN A 8 10.540 4.897 9.500 1.00 1.41 C ATOM 104 OD1 ASN A 8 11.018 4.135 8.682 1.00 2.20 O ATOM 105 ND2 ASN A 8 9.376 5.443 9.282 1.00 1.93 N ATOM 106 H ASN A 8 10.086 3.056 11.523 1.00 0.73 H ATOM 107 HA ASN A 8 12.766 3.683 10.558 1.00 0.93 H ATOM 108 HB2 ASN A 8 10.588 5.551 11.544 1.00 1.17 H ATOM 109 HB3 ASN A 8 12.005 6.012 10.599 1.00 1.28 H ATOM 110 HD21 ASN A 8 8.992 6.057 9.942 1.00 2.17 H ATOM 111 HD22 ASN A 8 8.886 5.240 8.458 1.00 2.51 H ATOM 112 N ARG A 9 12.351 3.597 13.663 1.00 0.82 N ATOM 113 CA ARG A 9 12.972 3.844 15.003 1.00 0.91 C ATOM 114 C ARG A 9 13.959 2.718 15.326 1.00 0.96 C ATOM 115 O ARG A 9 15.023 2.629 14.748 1.00 1.24 O ATOM 116 CB ARG A 9 11.871 3.873 16.067 1.00 0.92 C ATOM 117 CG ARG A 9 10.851 4.968 15.732 1.00 1.02 C ATOM 118 CD ARG A 9 11.513 6.351 15.806 1.00 1.43 C ATOM 119 NE ARG A 9 10.470 7.381 16.072 1.00 1.91 N ATOM 120 CZ ARG A 9 10.818 8.575 16.465 1.00 2.30 C ATOM 121 NH1 ARG A 9 12.080 8.866 16.625 1.00 2.49 N ATOM 122 NH2 ARG A 9 9.904 9.476 16.699 1.00 3.03 N ATOM 123 H ARG A 9 11.662 2.907 13.570 1.00 0.83 H ATOM 124 HA ARG A 9 13.496 4.790 15.004 1.00 1.00 H ATOM 125 HB2 ARG A 9 11.371 2.916 16.090 1.00 0.85 H ATOM 126 HB3 ARG A 9 12.308 4.073 17.034 1.00 1.04 H ATOM 127 HG2 ARG A 9 10.467 4.806 14.735 1.00 1.21 H ATOM 128 HG3 ARG A 9 10.037 4.925 16.440 1.00 1.26 H ATOM 129 HD2 ARG A 9 12.242 6.367 16.603 1.00 1.85 H ATOM 130 HD3 ARG A 9 12.000 6.569 14.867 1.00 1.88 H ATOM 131 HE ARG A 9 9.522 7.161 15.953 1.00 2.40 H ATOM 132 HH11 ARG A 9 12.779 8.175 16.446 1.00 2.41 H ATOM 133 HH12 ARG A 9 12.347 9.781 16.927 1.00 3.07 H ATOM 134 HH21 ARG A 9 8.938 9.251 16.577 1.00 3.42 H ATOM 135 HH22 ARG A 9 10.171 10.391 17.001 1.00 3.43 H ATOM 136 N GLY A 10 13.614 1.858 16.248 1.00 0.85 N ATOM 137 CA GLY A 10 14.529 0.737 16.613 1.00 0.94 C ATOM 138 C GLY A 10 13.701 -0.423 17.164 1.00 0.89 C ATOM 139 O GLY A 10 14.219 -1.337 17.775 1.00 0.95 O ATOM 140 H GLY A 10 12.750 1.948 16.703 1.00 0.84 H ATOM 141 HA2 GLY A 10 15.073 0.411 15.737 1.00 0.97 H ATOM 142 HA3 GLY A 10 15.224 1.070 17.368 1.00 1.05 H ATOM 143 N ARG A 11 12.414 -0.388 16.948 1.00 0.81 N ATOM 144 CA ARG A 11 11.536 -1.480 17.451 1.00 0.79 C ATOM 145 C ARG A 11 11.579 -2.653 16.470 1.00 0.73 C ATOM 146 O ARG A 11 12.460 -2.737 15.638 1.00 0.85 O ATOM 147 CB ARG A 11 10.105 -0.949 17.575 1.00 0.80 C ATOM 148 CG ARG A 11 9.987 -0.098 18.846 1.00 1.25 C ATOM 149 CD ARG A 11 8.648 0.644 18.858 1.00 1.29 C ATOM 150 NE ARG A 11 8.490 1.398 17.583 1.00 0.91 N ATOM 151 CZ ARG A 11 7.332 1.899 17.254 1.00 1.19 C ATOM 152 NH1 ARG A 11 6.310 1.767 18.053 1.00 1.82 N ATOM 153 NH2 ARG A 11 7.195 2.539 16.127 1.00 1.51 N ATOM 154 H ARG A 11 12.024 0.360 16.451 1.00 0.79 H ATOM 155 HA ARG A 11 11.886 -1.809 18.419 1.00 0.88 H ATOM 156 HB2 ARG A 11 9.876 -0.342 16.710 1.00 1.13 H ATOM 157 HB3 ARG A 11 9.414 -1.776 17.630 1.00 1.03 H ATOM 158 HG2 ARG A 11 10.051 -0.738 19.714 1.00 1.80 H ATOM 159 HG3 ARG A 11 10.792 0.621 18.871 1.00 1.75 H ATOM 160 HD2 ARG A 11 7.840 -0.064 18.957 1.00 1.75 H ATOM 161 HD3 ARG A 11 8.627 1.331 19.692 1.00 1.88 H ATOM 162 HE ARG A 11 9.257 1.507 16.983 1.00 1.17 H ATOM 163 HH11 ARG A 11 6.412 1.281 18.921 1.00 2.09 H ATOM 164 HH12 ARG A 11 5.425 2.152 17.797 1.00 2.27 H ATOM 165 HH21 ARG A 11 7.979 2.646 15.516 1.00 1.73 H ATOM 166 HH22 ARG A 11 6.306 2.921 15.874 1.00 1.89 H ATOM 167 N ILE A 12 10.641 -3.565 16.566 1.00 0.72 N ATOM 168 CA ILE A 12 10.628 -4.749 15.643 1.00 0.67 C ATOM 169 C ILE A 12 9.231 -4.921 15.039 1.00 0.59 C ATOM 170 O ILE A 12 8.263 -5.144 15.739 1.00 0.66 O ATOM 171 CB ILE A 12 10.978 -6.021 16.427 1.00 0.77 C ATOM 172 CG1 ILE A 12 12.389 -5.902 17.054 1.00 0.94 C ATOM 173 CG2 ILE A 12 10.910 -7.227 15.481 1.00 0.74 C ATOM 174 CD1 ILE A 12 13.480 -6.311 16.052 1.00 0.99 C ATOM 175 H ILE A 12 9.945 -3.474 17.250 1.00 0.87 H ATOM 176 HA ILE A 12 11.343 -4.610 14.845 1.00 0.67 H ATOM 177 HB ILE A 12 10.249 -6.155 17.215 1.00 0.82 H ATOM 178 HG12 ILE A 12 12.560 -4.883 17.366 1.00 1.01 H ATOM 179 HG13 ILE A 12 12.446 -6.548 17.919 1.00 1.05 H ATOM 180 HG21 ILE A 12 11.399 -6.980 14.548 1.00 1.28 H ATOM 181 HG22 ILE A 12 11.406 -8.071 15.936 1.00 1.11 H ATOM 182 HG23 ILE A 12 9.876 -7.476 15.290 1.00 1.35 H ATOM 183 HD11 ILE A 12 13.222 -5.953 15.068 1.00 1.41 H ATOM 184 HD12 ILE A 12 14.425 -5.884 16.354 1.00 1.45 H ATOM 185 HD13 ILE A 12 13.563 -7.388 16.033 1.00 1.39 H ATOM 186 N LEU A 13 9.125 -4.841 13.739 1.00 0.54 N ATOM 187 CA LEU A 13 7.800 -5.022 13.075 1.00 0.55 C ATOM 188 C LEU A 13 7.616 -6.508 12.755 1.00 0.52 C ATOM 189 O LEU A 13 8.558 -7.190 12.403 1.00 0.56 O ATOM 190 CB LEU A 13 7.769 -4.217 11.769 1.00 0.65 C ATOM 191 CG LEU A 13 7.612 -2.711 12.065 1.00 0.63 C ATOM 192 CD1 LEU A 13 8.131 -1.898 10.875 1.00 0.84 C ATOM 193 CD2 LEU A 13 6.135 -2.361 12.293 1.00 0.98 C ATOM 194 H LEU A 13 9.923 -4.676 13.194 1.00 0.56 H ATOM 195 HA LEU A 13 7.010 -4.691 13.732 1.00 0.62 H ATOM 196 HB2 LEU A 13 8.694 -4.384 11.235 1.00 0.96 H ATOM 197 HB3 LEU A 13 6.944 -4.554 11.159 1.00 0.87 H ATOM 198 HG LEU A 13 8.184 -2.456 12.947 1.00 1.01 H ATOM 199 HD11 LEU A 13 7.672 -2.260 9.965 1.00 1.41 H ATOM 200 HD12 LEU A 13 7.881 -0.857 11.014 1.00 1.39 H ATOM 201 HD13 LEU A 13 9.204 -2.006 10.805 1.00 1.34 H ATOM 202 HD21 LEU A 13 5.543 -2.735 11.472 1.00 1.46 H ATOM 203 HD22 LEU A 13 5.792 -2.803 13.215 1.00 1.59 H ATOM 204 HD23 LEU A 13 6.028 -1.288 12.350 1.00 1.46 H ATOM 205 N LYS A 14 6.420 -7.024 12.869 1.00 0.50 N ATOM 206 CA LYS A 14 6.207 -8.474 12.563 1.00 0.52 C ATOM 207 C LYS A 14 5.874 -8.628 11.073 1.00 0.47 C ATOM 208 O LYS A 14 5.478 -7.686 10.416 1.00 0.54 O ATOM 209 CB LYS A 14 5.048 -9.017 13.423 1.00 0.61 C ATOM 210 CG LYS A 14 5.574 -9.477 14.798 1.00 1.17 C ATOM 211 CD LYS A 14 6.098 -10.922 14.708 1.00 0.88 C ATOM 212 CE LYS A 14 7.074 -11.193 15.855 1.00 1.33 C ATOM 213 NZ LYS A 14 6.406 -10.914 17.158 1.00 2.16 N ATOM 214 H LYS A 14 5.665 -6.463 13.155 1.00 0.51 H ATOM 215 HA LYS A 14 7.111 -9.026 12.782 1.00 0.57 H ATOM 216 HB2 LYS A 14 4.316 -8.235 13.565 1.00 0.86 H ATOM 217 HB3 LYS A 14 4.580 -9.853 12.920 1.00 0.82 H ATOM 218 HG2 LYS A 14 6.372 -8.820 15.117 1.00 1.75 H ATOM 219 HG3 LYS A 14 4.770 -9.436 15.518 1.00 1.93 H ATOM 220 HD2 LYS A 14 5.267 -11.609 14.775 1.00 1.43 H ATOM 221 HD3 LYS A 14 6.606 -11.068 13.767 1.00 1.05 H ATOM 222 HE2 LYS A 14 7.385 -12.227 15.825 1.00 1.60 H ATOM 223 HE3 LYS A 14 7.938 -10.554 15.750 1.00 1.80 H ATOM 224 HZ1 LYS A 14 5.433 -10.590 16.987 1.00 2.57 H ATOM 225 HZ2 LYS A 14 6.387 -11.783 17.730 1.00 2.59 H ATOM 226 HZ3 LYS A 14 6.931 -10.175 17.666 1.00 2.64 H ATOM 227 N THR A 15 6.039 -9.808 10.533 1.00 0.51 N ATOM 228 CA THR A 15 5.738 -10.018 9.085 1.00 0.53 C ATOM 229 C THR A 15 4.386 -9.391 8.747 1.00 0.55 C ATOM 230 O THR A 15 3.587 -9.107 9.618 1.00 1.14 O ATOM 231 CB THR A 15 5.688 -11.520 8.777 1.00 0.62 C ATOM 232 OG1 THR A 15 6.977 -12.084 8.968 1.00 0.98 O ATOM 233 CG2 THR A 15 5.244 -11.738 7.326 1.00 0.92 C ATOM 234 H THR A 15 6.364 -10.555 11.078 1.00 0.61 H ATOM 235 HA THR A 15 6.508 -9.554 8.487 1.00 0.52 H ATOM 236 HB THR A 15 4.983 -11.999 9.439 1.00 0.87 H ATOM 237 HG1 THR A 15 7.237 -12.514 8.150 1.00 1.41 H ATOM 238 HG21 THR A 15 5.775 -11.054 6.679 1.00 1.37 H ATOM 239 HG22 THR A 15 5.464 -12.754 7.032 1.00 1.40 H ATOM 240 HG23 THR A 15 4.182 -11.561 7.242 1.00 1.61 H ATOM 241 N GLY A 16 4.121 -9.175 7.489 1.00 0.57 N ATOM 242 CA GLY A 16 2.818 -8.568 7.102 1.00 0.54 C ATOM 243 C GLY A 16 2.872 -7.059 7.336 1.00 0.45 C ATOM 244 O GLY A 16 2.306 -6.285 6.590 1.00 0.44 O ATOM 245 H GLY A 16 4.777 -9.411 6.801 1.00 1.04 H ATOM 246 HA2 GLY A 16 2.618 -8.771 6.060 1.00 0.57 H ATOM 247 HA3 GLY A 16 2.031 -8.993 7.706 1.00 0.61 H ATOM 248 N GLU A 17 3.537 -6.632 8.380 1.00 0.44 N ATOM 249 CA GLU A 17 3.616 -5.168 8.679 1.00 0.41 C ATOM 250 C GLU A 17 4.864 -4.566 8.033 1.00 0.42 C ATOM 251 O GLU A 17 5.821 -5.254 7.735 1.00 0.54 O ATOM 252 CB GLU A 17 3.688 -4.961 10.193 1.00 0.49 C ATOM 253 CG GLU A 17 2.380 -5.424 10.836 1.00 0.66 C ATOM 254 CD GLU A 17 2.569 -5.540 12.348 1.00 1.24 C ATOM 255 OE1 GLU A 17 3.218 -4.675 12.912 1.00 2.07 O ATOM 256 OE2 GLU A 17 2.061 -6.492 12.917 1.00 1.81 O ATOM 257 H GLU A 17 3.977 -7.275 8.975 1.00 0.51 H ATOM 258 HA GLU A 17 2.737 -4.669 8.295 1.00 0.39 H ATOM 259 HB2 GLU A 17 4.513 -5.531 10.597 1.00 0.59 H ATOM 260 HB3 GLU A 17 3.838 -3.913 10.403 1.00 0.69 H ATOM 261 HG2 GLU A 17 1.601 -4.706 10.623 1.00 1.35 H ATOM 262 HG3 GLU A 17 2.102 -6.387 10.435 1.00 1.17 H ATOM 263 N SER A 18 4.858 -3.279 7.822 1.00 0.39 N ATOM 264 CA SER A 18 6.035 -2.611 7.202 1.00 0.44 C ATOM 265 C SER A 18 5.787 -1.101 7.168 1.00 0.50 C ATOM 266 O SER A 18 4.925 -0.592 7.858 1.00 0.91 O ATOM 267 CB SER A 18 6.223 -3.136 5.778 1.00 0.51 C ATOM 268 OG SER A 18 4.968 -3.145 5.111 1.00 1.35 O ATOM 269 H SER A 18 4.075 -2.747 8.074 1.00 0.42 H ATOM 270 HA SER A 18 6.919 -2.818 7.785 1.00 0.48 H ATOM 271 HB2 SER A 18 6.905 -2.498 5.243 1.00 0.97 H ATOM 272 HB3 SER A 18 6.628 -4.139 5.817 1.00 1.19 H ATOM 273 HG SER A 18 4.496 -3.938 5.375 1.00 1.83 H ATOM 274 N GLN A 19 6.528 -0.378 6.369 1.00 0.58 N ATOM 275 CA GLN A 19 6.327 1.103 6.286 1.00 0.56 C ATOM 276 C GLN A 19 6.537 1.552 4.839 1.00 0.56 C ATOM 277 O GLN A 19 7.398 1.052 4.142 1.00 0.65 O ATOM 278 CB GLN A 19 7.323 1.816 7.207 1.00 0.62 C ATOM 279 CG GLN A 19 8.749 1.386 6.862 1.00 1.20 C ATOM 280 CD GLN A 19 9.711 1.892 7.938 1.00 1.66 C ATOM 281 OE1 GLN A 19 10.908 1.722 7.826 1.00 2.44 O ATOM 282 NE2 GLN A 19 9.237 2.513 8.983 1.00 1.95 N ATOM 283 H GLN A 19 7.214 -0.809 5.817 1.00 0.93 H ATOM 284 HA GLN A 19 5.317 1.350 6.587 1.00 0.56 H ATOM 285 HB2 GLN A 19 7.229 2.885 7.078 1.00 1.14 H ATOM 286 HB3 GLN A 19 7.111 1.558 8.234 1.00 1.30 H ATOM 287 HG2 GLN A 19 8.797 0.308 6.815 1.00 1.90 H ATOM 288 HG3 GLN A 19 9.030 1.803 5.907 1.00 1.75 H ATOM 289 HE21 GLN A 19 8.271 2.653 9.075 1.00 2.10 H ATOM 290 HE22 GLN A 19 9.847 2.839 9.676 1.00 2.46 H ATOM 291 N ARG A 20 5.741 2.479 4.374 1.00 0.58 N ATOM 292 CA ARG A 20 5.877 2.945 2.962 1.00 0.63 C ATOM 293 C ARG A 20 6.957 4.034 2.870 1.00 0.61 C ATOM 294 O ARG A 20 7.875 4.086 3.664 1.00 0.76 O ATOM 295 CB ARG A 20 4.506 3.484 2.476 1.00 0.72 C ATOM 296 CG ARG A 20 4.128 2.845 1.127 1.00 0.99 C ATOM 297 CD ARG A 20 2.959 3.607 0.478 1.00 1.10 C ATOM 298 NE ARG A 20 3.495 4.638 -0.452 1.00 1.63 N ATOM 299 CZ ARG A 20 2.707 5.191 -1.332 1.00 2.03 C ATOM 300 NH1 ARG A 20 1.449 4.846 -1.387 1.00 2.24 N ATOM 301 NH2 ARG A 20 3.174 6.088 -2.156 1.00 2.84 N ATOM 302 H ARG A 20 5.043 2.858 4.948 1.00 0.63 H ATOM 303 HA ARG A 20 6.178 2.107 2.346 1.00 0.73 H ATOM 304 HB2 ARG A 20 3.752 3.232 3.207 1.00 1.12 H ATOM 305 HB3 ARG A 20 4.541 4.559 2.364 1.00 1.28 H ATOM 306 HG2 ARG A 20 4.983 2.876 0.467 1.00 1.75 H ATOM 307 HG3 ARG A 20 3.841 1.816 1.291 1.00 1.57 H ATOM 308 HD2 ARG A 20 2.341 2.915 -0.078 1.00 1.56 H ATOM 309 HD3 ARG A 20 2.361 4.086 1.239 1.00 1.51 H ATOM 310 HE ARG A 20 4.439 4.897 -0.407 1.00 2.22 H ATOM 311 HH11 ARG A 20 1.092 4.158 -0.755 1.00 2.19 H ATOM 312 HH12 ARG A 20 0.844 5.268 -2.061 1.00 2.86 H ATOM 313 HH21 ARG A 20 4.138 6.352 -2.113 1.00 3.28 H ATOM 314 HH22 ARG A 20 2.569 6.511 -2.830 1.00 3.26 H ATOM 315 N LYS A 21 6.855 4.887 1.887 1.00 0.59 N ATOM 316 CA LYS A 21 7.870 5.964 1.705 1.00 0.61 C ATOM 317 C LYS A 21 7.494 7.189 2.548 1.00 0.59 C ATOM 318 O LYS A 21 8.323 8.028 2.841 1.00 0.65 O ATOM 319 CB LYS A 21 7.910 6.365 0.222 1.00 0.70 C ATOM 320 CG LYS A 21 8.131 5.113 -0.678 1.00 0.80 C ATOM 321 CD LYS A 21 7.326 5.220 -1.988 1.00 0.86 C ATOM 322 CE LYS A 21 8.046 6.147 -2.971 1.00 1.07 C ATOM 323 NZ LYS A 21 8.440 7.405 -2.280 1.00 1.77 N ATOM 324 H LYS A 21 6.111 4.810 1.254 1.00 0.70 H ATOM 325 HA LYS A 21 8.842 5.603 2.005 1.00 0.64 H ATOM 326 HB2 LYS A 21 6.978 6.849 -0.028 1.00 0.74 H ATOM 327 HB3 LYS A 21 8.721 7.063 0.071 1.00 0.75 H ATOM 328 HG2 LYS A 21 9.181 5.027 -0.920 1.00 0.96 H ATOM 329 HG3 LYS A 21 7.821 4.221 -0.154 1.00 1.14 H ATOM 330 HD2 LYS A 21 7.241 4.238 -2.428 1.00 1.05 H ATOM 331 HD3 LYS A 21 6.338 5.603 -1.789 1.00 1.28 H ATOM 332 HE2 LYS A 21 8.929 5.653 -3.346 1.00 1.41 H ATOM 333 HE3 LYS A 21 7.387 6.378 -3.794 1.00 1.54 H ATOM 334 HZ1 LYS A 21 7.689 7.690 -1.620 1.00 2.36 H ATOM 335 HZ2 LYS A 21 9.321 7.248 -1.751 1.00 2.12 H ATOM 336 HZ3 LYS A 21 8.587 8.155 -2.988 1.00 2.14 H ATOM 337 N ASP A 22 6.249 7.308 2.927 1.00 0.56 N ATOM 338 CA ASP A 22 5.821 8.489 3.737 1.00 0.60 C ATOM 339 C ASP A 22 6.130 8.257 5.221 1.00 0.54 C ATOM 340 O ASP A 22 5.794 9.065 6.064 1.00 0.58 O ATOM 341 CB ASP A 22 4.317 8.708 3.559 1.00 0.66 C ATOM 342 CG ASP A 22 4.015 9.000 2.089 1.00 0.72 C ATOM 343 OD1 ASP A 22 4.948 9.296 1.360 1.00 1.29 O ATOM 344 OD2 ASP A 22 2.856 8.922 1.715 1.00 1.33 O ATOM 345 H ASP A 22 5.594 6.627 2.670 1.00 0.55 H ATOM 346 HA ASP A 22 6.350 9.367 3.397 1.00 0.70 H ATOM 347 HB2 ASP A 22 3.785 7.820 3.867 1.00 0.70 H ATOM 348 HB3 ASP A 22 4.001 9.545 4.162 1.00 0.75 H ATOM 349 N GLY A 23 6.767 7.166 5.550 1.00 0.50 N ATOM 350 CA GLY A 23 7.093 6.898 6.981 1.00 0.51 C ATOM 351 C GLY A 23 5.871 6.308 7.685 1.00 0.43 C ATOM 352 O GLY A 23 5.981 5.698 8.730 1.00 0.41 O ATOM 353 H GLY A 23 7.032 6.525 4.860 1.00 0.52 H ATOM 354 HA2 GLY A 23 7.914 6.197 7.036 1.00 0.54 H ATOM 355 HA3 GLY A 23 7.374 7.820 7.468 1.00 0.57 H ATOM 356 N ARG A 24 4.706 6.479 7.124 1.00 0.45 N ATOM 357 CA ARG A 24 3.487 5.919 7.770 1.00 0.42 C ATOM 358 C ARG A 24 3.551 4.394 7.716 1.00 0.39 C ATOM 359 O ARG A 24 4.173 3.821 6.844 1.00 0.45 O ATOM 360 CB ARG A 24 2.241 6.408 7.029 1.00 0.53 C ATOM 361 CG ARG A 24 2.235 5.849 5.606 1.00 0.63 C ATOM 362 CD ARG A 24 1.211 6.612 4.763 1.00 0.54 C ATOM 363 NE ARG A 24 1.548 8.064 4.768 1.00 0.86 N ATOM 364 CZ ARG A 24 0.989 8.868 3.907 1.00 0.99 C ATOM 365 NH1 ARG A 24 0.134 8.403 3.041 1.00 1.15 N ATOM 366 NH2 ARG A 24 1.284 10.139 3.915 1.00 1.49 N ATOM 367 H ARG A 24 4.634 6.972 6.280 1.00 0.52 H ATOM 368 HA ARG A 24 3.445 6.242 8.800 1.00 0.42 H ATOM 369 HB2 ARG A 24 1.358 6.071 7.551 1.00 1.00 H ATOM 370 HB3 ARG A 24 2.246 7.484 6.991 1.00 0.83 H ATOM 371 HG2 ARG A 24 3.218 5.960 5.172 1.00 0.99 H ATOM 372 HG3 ARG A 24 1.970 4.803 5.633 1.00 1.14 H ATOM 373 HD2 ARG A 24 1.230 6.242 3.749 1.00 0.71 H ATOM 374 HD3 ARG A 24 0.224 6.467 5.179 1.00 0.81 H ATOM 375 HE ARG A 24 2.190 8.415 5.420 1.00 1.33 H ATOM 376 HH11 ARG A 24 -0.094 7.429 3.038 1.00 1.19 H ATOM 377 HH12 ARG A 24 -0.296 9.019 2.381 1.00 1.54 H ATOM 378 HH21 ARG A 24 1.937 10.496 4.582 1.00 1.84 H ATOM 379 HH22 ARG A 24 0.855 10.756 3.255 1.00 1.69 H ATOM 380 N TYR A 25 2.925 3.728 8.646 1.00 0.36 N ATOM 381 CA TYR A 25 2.969 2.240 8.645 1.00 0.37 C ATOM 382 C TYR A 25 2.022 1.688 7.580 1.00 0.42 C ATOM 383 O TYR A 25 1.039 2.311 7.214 1.00 0.49 O ATOM 384 CB TYR A 25 2.560 1.711 10.021 1.00 0.38 C ATOM 385 CG TYR A 25 3.624 2.077 11.033 1.00 0.38 C ATOM 386 CD1 TYR A 25 4.913 1.536 10.920 1.00 0.42 C ATOM 387 CD2 TYR A 25 3.326 2.958 12.081 1.00 0.44 C ATOM 388 CE1 TYR A 25 5.901 1.876 11.851 1.00 0.47 C ATOM 389 CE2 TYR A 25 4.315 3.298 13.013 1.00 0.50 C ATOM 390 CZ TYR A 25 5.603 2.758 12.897 1.00 0.50 C ATOM 391 OH TYR A 25 6.576 3.093 13.816 1.00 0.59 O ATOM 392 H TYR A 25 2.435 4.205 9.348 1.00 0.38 H ATOM 393 HA TYR A 25 3.973 1.917 8.423 1.00 0.40 H ATOM 394 HB2 TYR A 25 1.615 2.148 10.308 1.00 0.40 H ATOM 395 HB3 TYR A 25 2.461 0.636 9.977 1.00 0.42 H ATOM 396 HD1 TYR A 25 5.143 0.854 10.116 1.00 0.46 H ATOM 397 HD2 TYR A 25 2.334 3.376 12.169 1.00 0.49 H ATOM 398 HE1 TYR A 25 6.896 1.461 11.760 1.00 0.53 H ATOM 399 HE2 TYR A 25 4.086 3.978 13.820 1.00 0.59 H ATOM 400 HH TYR A 25 7.172 2.345 13.903 1.00 0.64 H ATOM 401 N LEU A 26 2.323 0.514 7.085 1.00 0.45 N ATOM 402 CA LEU A 26 1.475 -0.126 6.037 1.00 0.55 C ATOM 403 C LEU A 26 1.412 -1.628 6.325 1.00 0.47 C ATOM 404 O LEU A 26 2.425 -2.289 6.445 1.00 0.54 O ATOM 405 CB LEU A 26 2.114 0.132 4.656 1.00 0.69 C ATOM 406 CG LEU A 26 1.574 -0.839 3.588 1.00 0.73 C ATOM 407 CD1 LEU A 26 0.050 -0.734 3.495 1.00 1.21 C ATOM 408 CD2 LEU A 26 2.181 -0.475 2.231 1.00 1.24 C ATOM 409 H LEU A 26 3.122 0.048 7.409 1.00 0.43 H ATOM 410 HA LEU A 26 0.479 0.292 6.063 1.00 0.62 H ATOM 411 HB2 LEU A 26 1.896 1.145 4.352 1.00 1.04 H ATOM 412 HB3 LEU A 26 3.184 0.010 4.735 1.00 1.07 H ATOM 413 HG LEU A 26 1.852 -1.852 3.837 1.00 1.39 H ATOM 414 HD11 LEU A 26 -0.232 0.295 3.329 1.00 1.77 H ATOM 415 HD12 LEU A 26 -0.298 -1.340 2.673 1.00 1.64 H ATOM 416 HD13 LEU A 26 -0.396 -1.087 4.410 1.00 1.81 H ATOM 417 HD21 LEU A 26 3.257 -0.545 2.288 1.00 1.87 H ATOM 418 HD22 LEU A 26 1.814 -1.157 1.478 1.00 1.77 H ATOM 419 HD23 LEU A 26 1.899 0.535 1.970 1.00 1.63 H ATOM 420 N TYR A 27 0.224 -2.166 6.436 1.00 0.44 N ATOM 421 CA TYR A 27 0.059 -3.625 6.717 1.00 0.38 C ATOM 422 C TYR A 27 -0.701 -4.270 5.555 1.00 0.35 C ATOM 423 O TYR A 27 -1.895 -4.081 5.390 1.00 0.38 O ATOM 424 CB TYR A 27 -0.718 -3.781 8.032 1.00 0.41 C ATOM 425 CG TYR A 27 -1.192 -5.206 8.216 1.00 0.38 C ATOM 426 CD1 TYR A 27 -0.261 -6.230 8.398 1.00 0.37 C ATOM 427 CD2 TYR A 27 -2.563 -5.500 8.220 1.00 0.42 C ATOM 428 CE1 TYR A 27 -0.694 -7.549 8.585 1.00 0.37 C ATOM 429 CE2 TYR A 27 -2.997 -6.818 8.406 1.00 0.43 C ATOM 430 CZ TYR A 27 -2.063 -7.842 8.589 1.00 0.38 C ATOM 431 OH TYR A 27 -2.490 -9.141 8.771 1.00 0.41 O ATOM 432 H TYR A 27 -0.571 -1.602 6.334 1.00 0.51 H ATOM 433 HA TYR A 27 1.025 -4.100 6.814 1.00 0.37 H ATOM 434 HB2 TYR A 27 -0.069 -3.517 8.854 1.00 0.45 H ATOM 435 HB3 TYR A 27 -1.563 -3.119 8.025 1.00 0.46 H ATOM 436 HD1 TYR A 27 0.792 -6.003 8.397 1.00 0.41 H ATOM 437 HD2 TYR A 27 -3.285 -4.710 8.079 1.00 0.49 H ATOM 438 HE1 TYR A 27 0.026 -8.340 8.728 1.00 0.41 H ATOM 439 HE2 TYR A 27 -4.053 -7.044 8.414 1.00 0.50 H ATOM 440 HH TYR A 27 -3.055 -9.374 8.029 1.00 0.98 H ATOM 441 N LYS A 28 -0.002 -5.023 4.741 1.00 0.35 N ATOM 442 CA LYS A 28 -0.644 -5.701 3.575 1.00 0.37 C ATOM 443 C LYS A 28 -1.015 -7.129 3.991 1.00 0.38 C ATOM 444 O LYS A 28 -0.246 -7.809 4.642 1.00 0.44 O ATOM 445 CB LYS A 28 0.353 -5.729 2.394 1.00 0.47 C ATOM 446 CG LYS A 28 -0.388 -5.632 1.047 1.00 0.45 C ATOM 447 CD LYS A 28 0.580 -5.969 -0.104 1.00 0.62 C ATOM 448 CE LYS A 28 0.087 -5.353 -1.425 1.00 0.44 C ATOM 449 NZ LYS A 28 0.618 -6.148 -2.568 1.00 1.17 N ATOM 450 H LYS A 28 0.957 -5.144 4.902 1.00 0.38 H ATOM 451 HA LYS A 28 -1.538 -5.165 3.290 1.00 0.39 H ATOM 452 HB2 LYS A 28 1.028 -4.892 2.485 1.00 0.73 H ATOM 453 HB3 LYS A 28 0.924 -6.647 2.418 1.00 0.78 H ATOM 454 HG2 LYS A 28 -1.213 -6.330 1.041 1.00 0.96 H ATOM 455 HG3 LYS A 28 -0.766 -4.628 0.918 1.00 0.86 H ATOM 456 HD2 LYS A 28 1.563 -5.579 0.124 1.00 1.08 H ATOM 457 HD3 LYS A 28 0.641 -7.042 -0.214 1.00 1.17 H ATOM 458 HE2 LYS A 28 -0.994 -5.360 -1.456 1.00 0.75 H ATOM 459 HE3 LYS A 28 0.441 -4.335 -1.503 1.00 0.59 H ATOM 460 HZ1 LYS A 28 1.458 -6.679 -2.259 1.00 1.74 H ATOM 461 HZ2 LYS A 28 -0.111 -6.812 -2.897 1.00 1.63 H ATOM 462 HZ3 LYS A 28 0.877 -5.509 -3.345 1.00 1.68 H ATOM 463 N TYR A 29 -2.174 -7.598 3.622 1.00 0.39 N ATOM 464 CA TYR A 29 -2.564 -8.990 4.002 1.00 0.46 C ATOM 465 C TYR A 29 -3.568 -9.543 2.990 1.00 0.47 C ATOM 466 O TYR A 29 -4.556 -8.915 2.664 1.00 0.53 O ATOM 467 CB TYR A 29 -3.165 -9.003 5.414 1.00 0.55 C ATOM 468 CG TYR A 29 -4.539 -8.372 5.416 1.00 0.57 C ATOM 469 CD1 TYR A 29 -5.671 -9.157 5.157 1.00 0.60 C ATOM 470 CD2 TYR A 29 -4.684 -7.006 5.687 1.00 0.60 C ATOM 471 CE1 TYR A 29 -6.945 -8.576 5.169 1.00 0.68 C ATOM 472 CE2 TYR A 29 -5.958 -6.426 5.698 1.00 0.66 C ATOM 473 CZ TYR A 29 -7.088 -7.210 5.438 1.00 0.70 C ATOM 474 OH TYR A 29 -8.343 -6.636 5.450 1.00 0.80 O ATOM 475 H TYR A 29 -2.782 -7.043 3.091 1.00 0.39 H ATOM 476 HA TYR A 29 -1.683 -9.618 3.990 1.00 0.50 H ATOM 477 HB2 TYR A 29 -3.243 -10.024 5.757 1.00 0.60 H ATOM 478 HB3 TYR A 29 -2.519 -8.452 6.081 1.00 0.59 H ATOM 479 HD1 TYR A 29 -5.560 -10.211 4.947 1.00 0.61 H ATOM 480 HD2 TYR A 29 -3.813 -6.400 5.888 1.00 0.60 H ATOM 481 HE1 TYR A 29 -7.817 -9.182 4.971 1.00 0.74 H ATOM 482 HE2 TYR A 29 -6.070 -5.372 5.906 1.00 0.70 H ATOM 483 HH TYR A 29 -8.929 -7.213 5.947 1.00 1.06 H ATOM 484 N ILE A 30 -3.306 -10.718 2.488 1.00 0.49 N ATOM 485 CA ILE A 30 -4.217 -11.337 1.487 1.00 0.53 C ATOM 486 C ILE A 30 -5.500 -11.795 2.185 1.00 0.58 C ATOM 487 O ILE A 30 -5.475 -12.614 3.082 1.00 0.65 O ATOM 488 CB ILE A 30 -3.519 -12.543 0.829 1.00 0.59 C ATOM 489 CG1 ILE A 30 -2.051 -12.202 0.477 1.00 0.73 C ATOM 490 CG2 ILE A 30 -4.261 -12.948 -0.446 1.00 0.58 C ATOM 491 CD1 ILE A 30 -1.961 -11.253 -0.729 1.00 0.81 C ATOM 492 H ILE A 30 -2.498 -11.194 2.768 1.00 0.53 H ATOM 493 HA ILE A 30 -4.472 -10.608 0.736 1.00 0.52 H ATOM 494 HB ILE A 30 -3.534 -13.374 1.519 1.00 0.67 H ATOM 495 HG12 ILE A 30 -1.569 -11.742 1.324 1.00 1.03 H ATOM 496 HG13 ILE A 30 -1.530 -13.113 0.235 1.00 0.75 H ATOM 497 HG21 ILE A 30 -4.409 -12.079 -1.073 1.00 1.19 H ATOM 498 HG22 ILE A 30 -3.675 -13.682 -0.982 1.00 1.03 H ATOM 499 HG23 ILE A 30 -5.218 -13.371 -0.186 1.00 1.28 H ATOM 500 HD11 ILE A 30 -2.911 -10.780 -0.913 1.00 1.23 H ATOM 501 HD12 ILE A 30 -1.217 -10.497 -0.528 1.00 1.27 H ATOM 502 HD13 ILE A 30 -1.668 -11.817 -1.601 1.00 1.47 H ATOM 503 N ASP A 31 -6.624 -11.260 1.782 1.00 0.60 N ATOM 504 CA ASP A 31 -7.916 -11.647 2.423 1.00 0.71 C ATOM 505 C ASP A 31 -8.411 -12.972 1.826 1.00 0.77 C ATOM 506 O ASP A 31 -7.845 -13.496 0.887 1.00 0.87 O ATOM 507 CB ASP A 31 -8.965 -10.532 2.192 1.00 0.78 C ATOM 508 CG ASP A 31 -8.596 -9.712 0.952 1.00 1.33 C ATOM 509 OD1 ASP A 31 -7.489 -9.198 0.913 1.00 2.05 O ATOM 510 OD2 ASP A 31 -9.428 -9.603 0.067 1.00 1.92 O ATOM 511 H ASP A 31 -6.617 -10.592 1.063 1.00 0.58 H ATOM 512 HA ASP A 31 -7.760 -11.778 3.485 1.00 0.74 H ATOM 513 HB2 ASP A 31 -9.947 -10.967 2.053 1.00 1.14 H ATOM 514 HB3 ASP A 31 -8.989 -9.878 3.052 1.00 1.13 H ATOM 515 N SER A 32 -9.461 -13.519 2.378 1.00 1.04 N ATOM 516 CA SER A 32 -9.994 -14.814 1.865 1.00 1.16 C ATOM 517 C SER A 32 -10.552 -14.637 0.450 1.00 1.17 C ATOM 518 O SER A 32 -11.218 -15.511 -0.070 1.00 1.31 O ATOM 519 CB SER A 32 -11.113 -15.303 2.787 1.00 1.34 C ATOM 520 OG SER A 32 -10.585 -15.552 4.083 1.00 2.06 O ATOM 521 H SER A 32 -9.894 -13.081 3.142 1.00 1.29 H ATOM 522 HA SER A 32 -9.202 -15.547 1.849 1.00 1.15 H ATOM 523 HB2 SER A 32 -11.878 -14.549 2.855 1.00 1.68 H ATOM 524 HB3 SER A 32 -11.538 -16.209 2.380 1.00 1.45 H ATOM 525 HG SER A 32 -11.048 -16.305 4.453 1.00 2.49 H ATOM 526 N PHE A 33 -10.290 -13.522 -0.183 1.00 1.06 N ATOM 527 CA PHE A 33 -10.808 -13.298 -1.566 1.00 1.13 C ATOM 528 C PHE A 33 -9.685 -13.578 -2.568 1.00 1.02 C ATOM 529 O PHE A 33 -9.923 -13.984 -3.689 1.00 1.13 O ATOM 530 CB PHE A 33 -11.266 -11.840 -1.697 1.00 1.17 C ATOM 531 CG PHE A 33 -12.666 -11.689 -1.140 1.00 1.42 C ATOM 532 CD1 PHE A 33 -13.775 -11.956 -1.952 1.00 1.66 C ATOM 533 CD2 PHE A 33 -12.852 -11.289 0.189 1.00 1.47 C ATOM 534 CE1 PHE A 33 -15.070 -11.819 -1.436 1.00 1.90 C ATOM 535 CE2 PHE A 33 -14.146 -11.154 0.705 1.00 1.73 C ATOM 536 CZ PHE A 33 -15.254 -11.420 -0.107 1.00 1.92 C ATOM 537 H PHE A 33 -9.750 -12.829 0.250 1.00 0.97 H ATOM 538 HA PHE A 33 -11.640 -13.962 -1.768 1.00 1.30 H ATOM 539 HB2 PHE A 33 -10.593 -11.207 -1.143 1.00 1.06 H ATOM 540 HB3 PHE A 33 -11.258 -11.549 -2.734 1.00 1.19 H ATOM 541 HD1 PHE A 33 -13.632 -12.264 -2.977 1.00 1.69 H ATOM 542 HD2 PHE A 33 -11.996 -11.083 0.816 1.00 1.37 H ATOM 543 HE1 PHE A 33 -15.925 -12.024 -2.062 1.00 2.11 H ATOM 544 HE2 PHE A 33 -14.289 -10.844 1.730 1.00 1.81 H ATOM 545 HZ PHE A 33 -16.253 -11.316 0.292 1.00 2.13 H ATOM 546 N GLY A 34 -8.461 -13.356 -2.170 1.00 0.86 N ATOM 547 CA GLY A 34 -7.304 -13.598 -3.086 1.00 0.85 C ATOM 548 C GLY A 34 -6.835 -12.263 -3.659 1.00 0.75 C ATOM 549 O GLY A 34 -6.287 -12.199 -4.742 1.00 0.88 O ATOM 550 H GLY A 34 -8.302 -13.024 -1.264 1.00 0.81 H ATOM 551 HA2 GLY A 34 -6.497 -14.057 -2.531 1.00 0.88 H ATOM 552 HA3 GLY A 34 -7.599 -14.251 -3.896 1.00 0.98 H ATOM 553 N GLU A 35 -7.049 -11.194 -2.935 1.00 0.66 N ATOM 554 CA GLU A 35 -6.621 -9.841 -3.420 1.00 0.67 C ATOM 555 C GLU A 35 -5.993 -9.075 -2.233 1.00 0.57 C ATOM 556 O GLU A 35 -6.675 -8.786 -1.270 1.00 0.56 O ATOM 557 CB GLU A 35 -7.853 -9.061 -3.968 1.00 0.85 C ATOM 558 CG GLU A 35 -9.129 -9.902 -3.828 1.00 1.19 C ATOM 559 CD GLU A 35 -10.297 -9.165 -4.482 1.00 1.86 C ATOM 560 OE1 GLU A 35 -10.274 -7.945 -4.486 1.00 2.45 O ATOM 561 OE2 GLU A 35 -11.195 -9.832 -4.968 1.00 2.51 O ATOM 562 H GLU A 35 -7.495 -11.279 -2.063 1.00 0.71 H ATOM 563 HA GLU A 35 -5.896 -9.960 -4.209 1.00 0.74 H ATOM 564 HB2 GLU A 35 -7.983 -8.135 -3.423 1.00 1.22 H ATOM 565 HB3 GLU A 35 -7.700 -8.832 -5.014 1.00 1.16 H ATOM 566 HG2 GLU A 35 -8.988 -10.856 -4.316 1.00 1.10 H ATOM 567 HG3 GLU A 35 -9.347 -10.061 -2.783 1.00 1.82 H ATOM 568 N PRO A 36 -4.716 -8.743 -2.279 1.00 0.55 N ATOM 569 CA PRO A 36 -4.058 -8.005 -1.163 1.00 0.50 C ATOM 570 C PRO A 36 -4.936 -6.868 -0.621 1.00 0.50 C ATOM 571 O PRO A 36 -5.750 -6.311 -1.332 1.00 0.66 O ATOM 572 CB PRO A 36 -2.778 -7.459 -1.799 1.00 0.59 C ATOM 573 CG PRO A 36 -2.432 -8.447 -2.869 1.00 0.66 C ATOM 574 CD PRO A 36 -3.762 -9.023 -3.374 1.00 0.64 C ATOM 575 HA PRO A 36 -3.802 -8.684 -0.369 1.00 0.47 H ATOM 576 HB2 PRO A 36 -2.956 -6.480 -2.228 1.00 0.63 H ATOM 577 HB3 PRO A 36 -1.985 -7.411 -1.067 1.00 0.60 H ATOM 578 HG2 PRO A 36 -1.903 -7.952 -3.676 1.00 0.75 H ATOM 579 HG3 PRO A 36 -1.823 -9.242 -2.461 1.00 0.66 H ATOM 580 HD2 PRO A 36 -4.069 -8.523 -4.284 1.00 0.72 H ATOM 581 HD3 PRO A 36 -3.681 -10.088 -3.533 1.00 0.66 H ATOM 582 N GLN A 37 -4.776 -6.528 0.636 1.00 0.42 N ATOM 583 CA GLN A 37 -5.595 -5.433 1.251 1.00 0.46 C ATOM 584 C GLN A 37 -4.662 -4.418 1.925 1.00 0.41 C ATOM 585 O GLN A 37 -3.738 -4.781 2.621 1.00 0.49 O ATOM 586 CB GLN A 37 -6.543 -6.046 2.292 1.00 0.52 C ATOM 587 CG GLN A 37 -7.514 -4.964 2.847 1.00 0.63 C ATOM 588 CD GLN A 37 -8.962 -5.464 2.778 1.00 1.07 C ATOM 589 OE1 GLN A 37 -9.651 -5.513 3.777 1.00 1.79 O ATOM 590 NE2 GLN A 37 -9.451 -5.837 1.629 1.00 1.83 N ATOM 591 H GLN A 37 -4.113 -7.001 1.182 1.00 0.44 H ATOM 592 HA GLN A 37 -6.176 -4.929 0.490 1.00 0.53 H ATOM 593 HB2 GLN A 37 -7.102 -6.850 1.824 1.00 0.60 H ATOM 594 HB3 GLN A 37 -5.957 -6.456 3.101 1.00 0.48 H ATOM 595 HG2 GLN A 37 -7.266 -4.746 3.876 1.00 1.22 H ATOM 596 HG3 GLN A 37 -7.431 -4.054 2.266 1.00 1.16 H ATOM 597 HE21 GLN A 37 -8.893 -5.794 0.823 1.00 2.18 H ATOM 598 HE22 GLN A 37 -10.373 -6.160 1.569 1.00 2.44 H ATOM 599 N PHE A 38 -4.886 -3.145 1.702 1.00 0.38 N ATOM 600 CA PHE A 38 -3.998 -2.093 2.301 1.00 0.36 C ATOM 601 C PHE A 38 -4.619 -1.486 3.572 1.00 0.35 C ATOM 602 O PHE A 38 -5.765 -1.081 3.588 1.00 0.40 O ATOM 603 CB PHE A 38 -3.806 -0.960 1.266 1.00 0.42 C ATOM 604 CG PHE A 38 -2.591 -1.214 0.396 1.00 0.46 C ATOM 605 CD1 PHE A 38 -2.616 -2.227 -0.565 1.00 0.54 C ATOM 606 CD2 PHE A 38 -1.447 -0.418 0.541 1.00 0.60 C ATOM 607 CE1 PHE A 38 -1.501 -2.443 -1.377 1.00 0.59 C ATOM 608 CE2 PHE A 38 -0.330 -0.639 -0.270 1.00 0.67 C ATOM 609 CZ PHE A 38 -0.358 -1.651 -1.231 1.00 0.60 C ATOM 610 H PHE A 38 -5.626 -2.879 1.119 1.00 0.46 H ATOM 611 HA PHE A 38 -3.037 -2.522 2.547 1.00 0.35 H ATOM 612 HB2 PHE A 38 -4.681 -0.908 0.636 1.00 0.47 H ATOM 613 HB3 PHE A 38 -3.683 -0.011 1.774 1.00 0.45 H ATOM 614 HD1 PHE A 38 -3.493 -2.845 -0.680 1.00 0.67 H ATOM 615 HD2 PHE A 38 -1.425 0.362 1.284 1.00 0.74 H ATOM 616 HE1 PHE A 38 -1.524 -3.217 -2.117 1.00 0.73 H ATOM 617 HE2 PHE A 38 0.551 -0.026 -0.156 1.00 0.86 H ATOM 618 HZ PHE A 38 0.502 -1.822 -1.862 1.00 0.67 H ATOM 619 N VAL A 39 -3.830 -1.364 4.613 1.00 0.33 N ATOM 620 CA VAL A 39 -4.305 -0.716 5.879 1.00 0.33 C ATOM 621 C VAL A 39 -3.262 0.349 6.243 1.00 0.32 C ATOM 622 O VAL A 39 -2.102 0.043 6.439 1.00 0.35 O ATOM 623 CB VAL A 39 -4.412 -1.749 7.004 1.00 0.34 C ATOM 624 CG1 VAL A 39 -4.891 -1.066 8.289 1.00 0.36 C ATOM 625 CG2 VAL A 39 -5.410 -2.839 6.612 1.00 0.48 C ATOM 626 H VAL A 39 -2.896 -1.666 4.548 1.00 0.33 H ATOM 627 HA VAL A 39 -5.265 -0.241 5.720 1.00 0.36 H ATOM 628 HB VAL A 39 -3.446 -2.190 7.172 1.00 0.40 H ATOM 629 HG11 VAL A 39 -5.823 -0.555 8.098 1.00 1.02 H ATOM 630 HG12 VAL A 39 -5.041 -1.810 9.059 1.00 1.10 H ATOM 631 HG13 VAL A 39 -4.149 -0.354 8.617 1.00 1.02 H ATOM 632 HG21 VAL A 39 -5.183 -3.197 5.618 1.00 1.06 H ATOM 633 HG22 VAL A 39 -5.338 -3.656 7.314 1.00 1.00 H ATOM 634 HG23 VAL A 39 -6.411 -2.434 6.630 1.00 1.05 H ATOM 635 N TYR A 40 -3.649 1.603 6.287 1.00 0.36 N ATOM 636 CA TYR A 40 -2.659 2.695 6.583 1.00 0.37 C ATOM 637 C TYR A 40 -2.796 3.197 8.019 1.00 0.35 C ATOM 638 O TYR A 40 -3.811 3.022 8.664 1.00 0.40 O ATOM 639 CB TYR A 40 -2.922 3.873 5.638 1.00 0.47 C ATOM 640 CG TYR A 40 -2.440 3.535 4.253 1.00 0.50 C ATOM 641 CD1 TYR A 40 -1.104 3.756 3.907 1.00 0.60 C ATOM 642 CD2 TYR A 40 -3.330 3.006 3.313 1.00 0.53 C ATOM 643 CE1 TYR A 40 -0.656 3.448 2.620 1.00 0.67 C ATOM 644 CE2 TYR A 40 -2.883 2.698 2.024 1.00 0.58 C ATOM 645 CZ TYR A 40 -1.545 2.920 1.677 1.00 0.63 C ATOM 646 OH TYR A 40 -1.103 2.617 0.406 1.00 0.72 O ATOM 647 H TYR A 40 -4.581 1.831 6.090 1.00 0.41 H ATOM 648 HA TYR A 40 -1.652 2.336 6.425 1.00 0.37 H ATOM 649 HB2 TYR A 40 -3.982 4.079 5.608 1.00 0.51 H ATOM 650 HB3 TYR A 40 -2.397 4.748 5.994 1.00 0.51 H ATOM 651 HD1 TYR A 40 -0.418 4.164 4.635 1.00 0.67 H ATOM 652 HD2 TYR A 40 -4.362 2.836 3.582 1.00 0.59 H ATOM 653 HE1 TYR A 40 0.375 3.618 2.354 1.00 0.80 H ATOM 654 HE2 TYR A 40 -3.568 2.289 1.299 1.00 0.65 H ATOM 655 HH TYR A 40 -1.341 3.346 -0.172 1.00 0.69 H ATOM 656 N SER A 41 -1.765 3.836 8.510 1.00 0.35 N ATOM 657 CA SER A 41 -1.798 4.379 9.898 1.00 0.37 C ATOM 658 C SER A 41 -0.473 5.094 10.190 1.00 0.39 C ATOM 659 O SER A 41 0.469 4.993 9.431 1.00 0.60 O ATOM 660 CB SER A 41 -1.981 3.231 10.877 1.00 0.36 C ATOM 661 OG SER A 41 -1.647 3.670 12.186 1.00 0.92 O ATOM 662 H SER A 41 -0.962 3.961 7.956 1.00 0.38 H ATOM 663 HA SER A 41 -2.617 5.076 9.996 1.00 0.40 H ATOM 664 HB2 SER A 41 -3.006 2.899 10.863 1.00 0.81 H ATOM 665 HB3 SER A 41 -1.338 2.420 10.582 1.00 0.83 H ATOM 666 HG SER A 41 -2.193 4.433 12.391 1.00 1.11 H ATOM 667 N TRP A 42 -0.394 5.814 11.286 1.00 0.35 N ATOM 668 CA TRP A 42 0.868 6.544 11.637 1.00 0.37 C ATOM 669 C TRP A 42 1.401 6.015 12.972 1.00 0.37 C ATOM 670 O TRP A 42 2.593 5.944 13.196 1.00 0.40 O ATOM 671 CB TRP A 42 0.549 8.036 11.786 1.00 0.40 C ATOM 672 CG TRP A 42 0.413 8.674 10.441 1.00 0.41 C ATOM 673 CD1 TRP A 42 -0.759 9.039 9.873 1.00 0.45 C ATOM 674 CD2 TRP A 42 1.460 9.036 9.493 1.00 0.43 C ATOM 675 NE1 TRP A 42 -0.499 9.604 8.638 1.00 0.48 N ATOM 676 CE2 TRP A 42 0.853 9.625 8.358 1.00 0.46 C ATOM 677 CE3 TRP A 42 2.862 8.913 9.505 1.00 0.44 C ATOM 678 CZ2 TRP A 42 1.609 10.076 7.277 1.00 0.49 C ATOM 679 CZ3 TRP A 42 3.626 9.366 8.416 1.00 0.48 C ATOM 680 CH2 TRP A 42 3.000 9.947 7.305 1.00 0.50 C ATOM 681 H TRP A 42 -1.169 5.879 11.885 1.00 0.47 H ATOM 682 HA TRP A 42 1.616 6.407 10.867 1.00 0.38 H ATOM 683 HB2 TRP A 42 -0.380 8.147 12.324 1.00 0.40 H ATOM 684 HB3 TRP A 42 1.343 8.524 12.334 1.00 0.41 H ATOM 685 HD1 TRP A 42 -1.738 8.911 10.314 1.00 0.48 H ATOM 686 HE1 TRP A 42 -1.177 9.953 8.021 1.00 0.52 H ATOM 687 HE3 TRP A 42 3.353 8.466 10.357 1.00 0.44 H ATOM 688 HZ2 TRP A 42 1.122 10.524 6.425 1.00 0.53 H ATOM 689 HZ3 TRP A 42 4.703 9.265 8.434 1.00 0.52 H ATOM 690 HH2 TRP A 42 3.592 10.294 6.470 1.00 0.54 H ATOM 691 N LYS A 43 0.518 5.662 13.868 1.00 0.36 N ATOM 692 CA LYS A 43 0.948 5.155 15.205 1.00 0.38 C ATOM 693 C LYS A 43 1.010 3.626 15.183 1.00 0.37 C ATOM 694 O LYS A 43 0.050 2.967 14.836 1.00 0.40 O ATOM 695 CB LYS A 43 -0.074 5.597 16.265 1.00 0.42 C ATOM 696 CG LYS A 43 -0.293 7.120 16.199 1.00 0.43 C ATOM 697 CD LYS A 43 -1.661 7.496 16.805 1.00 0.51 C ATOM 698 CE LYS A 43 -1.899 6.756 18.125 1.00 1.07 C ATOM 699 NZ LYS A 43 -2.873 7.528 18.947 1.00 2.03 N ATOM 700 H LYS A 43 -0.438 5.743 13.665 1.00 0.37 H ATOM 701 HA LYS A 43 1.921 5.554 15.457 1.00 0.41 H ATOM 702 HB2 LYS A 43 -1.010 5.092 16.084 1.00 0.45 H ATOM 703 HB3 LYS A 43 0.293 5.329 17.244 1.00 0.46 H ATOM 704 HG2 LYS A 43 0.490 7.618 16.751 1.00 0.53 H ATOM 705 HG3 LYS A 43 -0.267 7.447 15.168 1.00 0.49 H ATOM 706 HD2 LYS A 43 -1.688 8.556 16.994 1.00 1.19 H ATOM 707 HD3 LYS A 43 -2.442 7.239 16.106 1.00 1.11 H ATOM 708 HE2 LYS A 43 -2.299 5.774 17.921 1.00 1.75 H ATOM 709 HE3 LYS A 43 -0.969 6.665 18.665 1.00 1.42 H ATOM 710 HZ1 LYS A 43 -3.163 8.382 18.428 1.00 2.56 H ATOM 711 HZ2 LYS A 43 -3.708 6.939 19.140 1.00 2.49 H ATOM 712 HZ3 LYS A 43 -2.429 7.801 19.846 1.00 2.50 H ATOM 713 N LEU A 44 2.119 3.050 15.567 1.00 0.41 N ATOM 714 CA LEU A 44 2.204 1.562 15.578 1.00 0.42 C ATOM 715 C LEU A 44 1.358 1.052 16.740 1.00 0.44 C ATOM 716 O LEU A 44 0.721 0.024 16.654 1.00 0.47 O ATOM 717 CB LEU A 44 3.663 1.116 15.754 1.00 0.50 C ATOM 718 CG LEU A 44 3.746 -0.420 15.823 1.00 0.51 C ATOM 719 CD1 LEU A 44 3.153 -1.048 14.551 1.00 0.53 C ATOM 720 CD2 LEU A 44 5.213 -0.839 15.965 1.00 0.69 C ATOM 721 H LEU A 44 2.882 3.591 15.859 1.00 0.47 H ATOM 722 HA LEU A 44 1.812 1.177 14.651 1.00 0.40 H ATOM 723 HB2 LEU A 44 4.246 1.469 14.915 1.00 0.52 H ATOM 724 HB3 LEU A 44 4.057 1.536 16.667 1.00 0.56 H ATOM 725 HG LEU A 44 3.192 -0.771 16.681 1.00 0.62 H ATOM 726 HD11 LEU A 44 3.389 -0.431 13.696 1.00 1.13 H ATOM 727 HD12 LEU A 44 3.567 -2.036 14.404 1.00 1.12 H ATOM 728 HD13 LEU A 44 2.081 -1.124 14.656 1.00 1.23 H ATOM 729 HD21 LEU A 44 5.796 -0.385 15.177 1.00 1.29 H ATOM 730 HD22 LEU A 44 5.588 -0.515 16.926 1.00 1.10 H ATOM 731 HD23 LEU A 44 5.287 -1.915 15.893 1.00 1.27 H ATOM 732 N VAL A 45 1.328 1.789 17.820 1.00 0.46 N ATOM 733 CA VAL A 45 0.506 1.389 19.002 1.00 0.48 C ATOM 734 C VAL A 45 -0.214 2.634 19.505 1.00 0.49 C ATOM 735 O VAL A 45 0.224 3.746 19.286 1.00 0.50 O ATOM 736 CB VAL A 45 1.402 0.801 20.107 1.00 0.55 C ATOM 737 CG1 VAL A 45 2.412 -0.173 19.490 1.00 0.60 C ATOM 738 CG2 VAL A 45 2.151 1.929 20.833 1.00 0.61 C ATOM 739 H VAL A 45 1.838 2.628 17.848 1.00 0.49 H ATOM 740 HA VAL A 45 -0.238 0.657 18.710 1.00 0.48 H ATOM 741 HB VAL A 45 0.785 0.263 20.813 1.00 0.56 H ATOM 742 HG11 VAL A 45 2.982 0.333 18.726 1.00 1.06 H ATOM 743 HG12 VAL A 45 3.081 -0.530 20.259 1.00 1.23 H ATOM 744 HG13 VAL A 45 1.886 -1.013 19.054 1.00 1.25 H ATOM 745 HG21 VAL A 45 2.561 2.614 20.106 1.00 1.10 H ATOM 746 HG22 VAL A 45 1.463 2.461 21.478 1.00 1.30 H ATOM 747 HG23 VAL A 45 2.950 1.510 21.426 1.00 1.16 H ATOM 748 N ALA A 46 -1.328 2.465 20.144 1.00 0.51 N ATOM 749 CA ALA A 46 -2.083 3.649 20.614 1.00 0.54 C ATOM 750 C ALA A 46 -1.325 4.338 21.748 1.00 0.58 C ATOM 751 O ALA A 46 -1.774 4.398 22.875 1.00 0.64 O ATOM 752 CB ALA A 46 -3.475 3.206 21.065 1.00 0.59 C ATOM 753 H ALA A 46 -1.683 1.564 20.289 1.00 0.53 H ATOM 754 HA ALA A 46 -2.177 4.344 19.797 1.00 0.53 H ATOM 755 HB1 ALA A 46 -3.401 2.244 21.552 1.00 1.23 H ATOM 756 HB2 ALA A 46 -3.887 3.932 21.751 1.00 0.94 H ATOM 757 HB3 ALA A 46 -4.122 3.120 20.196 1.00 1.19 H ATOM 758 N THR A 47 -0.178 4.877 21.435 1.00 0.57 N ATOM 759 CA THR A 47 0.633 5.593 22.458 1.00 0.63 C ATOM 760 C THR A 47 1.474 6.663 21.758 1.00 0.64 C ATOM 761 O THR A 47 1.765 7.704 22.311 1.00 0.71 O ATOM 762 CB THR A 47 1.552 4.604 23.177 1.00 0.68 C ATOM 763 OG1 THR A 47 0.815 3.437 23.514 1.00 1.01 O ATOM 764 CG2 THR A 47 2.096 5.250 24.449 1.00 1.34 C ATOM 765 H THR A 47 0.145 4.822 20.513 1.00 0.53 H ATOM 766 HA THR A 47 -0.023 6.062 23.174 1.00 0.67 H ATOM 767 HB THR A 47 2.375 4.339 22.532 1.00 1.15 H ATOM 768 HG1 THR A 47 1.367 2.890 24.078 1.00 1.43 H ATOM 769 HG21 THR A 47 2.617 6.161 24.195 1.00 1.96 H ATOM 770 HG22 THR A 47 1.277 5.478 25.114 1.00 1.89 H ATOM 771 HG23 THR A 47 2.777 4.569 24.937 1.00 1.64 H ATOM 772 N ASP A 48 1.864 6.405 20.539 1.00 0.59 N ATOM 773 CA ASP A 48 2.687 7.384 19.778 1.00 0.62 C ATOM 774 C ASP A 48 1.852 8.631 19.453 1.00 0.63 C ATOM 775 O ASP A 48 0.807 8.858 20.031 1.00 0.67 O ATOM 776 CB ASP A 48 3.154 6.717 18.479 1.00 0.57 C ATOM 777 CG ASP A 48 4.343 5.798 18.771 1.00 0.70 C ATOM 778 OD1 ASP A 48 4.240 5.003 19.690 1.00 1.43 O ATOM 779 OD2 ASP A 48 5.337 5.908 18.072 1.00 1.20 O ATOM 780 H ASP A 48 1.616 5.557 20.118 1.00 0.55 H ATOM 781 HA ASP A 48 3.545 7.670 20.368 1.00 0.69 H ATOM 782 HB2 ASP A 48 2.344 6.134 18.066 1.00 0.53 H ATOM 783 HB3 ASP A 48 3.451 7.468 17.768 1.00 0.59 H ATOM 784 N ARG A 49 2.313 9.440 18.527 1.00 0.63 N ATOM 785 CA ARG A 49 1.568 10.682 18.139 1.00 0.68 C ATOM 786 C ARG A 49 1.434 10.724 16.612 1.00 0.58 C ATOM 787 O ARG A 49 1.564 9.716 15.949 1.00 0.58 O ATOM 788 CB ARG A 49 2.353 11.909 18.611 1.00 0.85 C ATOM 789 CG ARG A 49 2.270 12.024 20.140 1.00 0.99 C ATOM 790 CD ARG A 49 0.847 12.414 20.583 1.00 1.36 C ATOM 791 NE ARG A 49 0.932 13.230 21.828 1.00 1.88 N ATOM 792 CZ ARG A 49 -0.105 13.908 22.239 1.00 2.40 C ATOM 793 NH1 ARG A 49 -1.226 13.854 21.572 1.00 2.80 N ATOM 794 NH2 ARG A 49 -0.021 14.639 23.316 1.00 3.01 N ATOM 795 H ARG A 49 3.159 9.227 18.080 1.00 0.65 H ATOM 796 HA ARG A 49 0.585 10.686 18.589 1.00 0.71 H ATOM 797 HB2 ARG A 49 3.386 11.804 18.317 1.00 0.87 H ATOM 798 HB3 ARG A 49 1.943 12.798 18.159 1.00 0.90 H ATOM 799 HG2 ARG A 49 2.536 11.074 20.582 1.00 0.91 H ATOM 800 HG3 ARG A 49 2.965 12.779 20.476 1.00 1.17 H ATOM 801 HD2 ARG A 49 0.361 12.995 19.813 1.00 1.61 H ATOM 802 HD3 ARG A 49 0.269 11.522 20.777 1.00 1.60 H ATOM 803 HE ARG A 49 1.771 13.265 22.334 1.00 2.26 H ATOM 804 HH11 ARG A 49 -1.291 13.292 20.747 1.00 2.68 H ATOM 805 HH12 ARG A 49 -2.020 14.374 21.887 1.00 3.48 H ATOM 806 HH21 ARG A 49 0.837 14.679 23.828 1.00 3.21 H ATOM 807 HH22 ARG A 49 -0.815 15.160 23.630 1.00 3.52 H ATOM 808 N VAL A 50 1.183 11.879 16.044 1.00 0.76 N ATOM 809 CA VAL A 50 1.047 11.972 14.555 1.00 0.69 C ATOM 810 C VAL A 50 1.330 13.420 14.106 1.00 0.69 C ATOM 811 O VAL A 50 0.687 14.340 14.571 1.00 0.70 O ATOM 812 CB VAL A 50 -0.384 11.601 14.129 1.00 0.67 C ATOM 813 CG1 VAL A 50 -0.650 10.128 14.431 1.00 0.76 C ATOM 814 CG2 VAL A 50 -1.403 12.475 14.879 1.00 0.71 C ATOM 815 H VAL A 50 1.085 12.685 16.593 1.00 1.02 H ATOM 816 HA VAL A 50 1.738 11.288 14.097 1.00 0.74 H ATOM 817 HB VAL A 50 -0.488 11.765 13.065 1.00 0.64 H ATOM 818 HG11 VAL A 50 0.184 9.535 14.092 1.00 1.25 H ATOM 819 HG12 VAL A 50 -0.775 9.999 15.491 1.00 1.40 H ATOM 820 HG13 VAL A 50 -1.548 9.812 13.921 1.00 1.17 H ATOM 821 HG21 VAL A 50 -1.094 12.595 15.906 1.00 1.12 H ATOM 822 HG22 VAL A 50 -1.462 13.443 14.405 1.00 1.11 H ATOM 823 HG23 VAL A 50 -2.376 12.004 14.850 1.00 1.42 H ATOM 824 N PRO A 51 2.271 13.642 13.207 1.00 0.75 N ATOM 825 CA PRO A 51 2.585 15.016 12.722 1.00 0.83 C ATOM 826 C PRO A 51 1.326 15.842 12.453 1.00 0.81 C ATOM 827 O PRO A 51 0.398 15.394 11.810 1.00 0.82 O ATOM 828 CB PRO A 51 3.363 14.772 11.427 1.00 0.90 C ATOM 829 CG PRO A 51 4.050 13.460 11.635 1.00 0.95 C ATOM 830 CD PRO A 51 3.140 12.636 12.559 1.00 0.83 C ATOM 831 HA PRO A 51 3.212 15.529 13.427 1.00 0.91 H ATOM 832 HB2 PRO A 51 2.683 14.715 10.586 1.00 0.86 H ATOM 833 HB3 PRO A 51 4.091 15.555 11.269 1.00 1.02 H ATOM 834 HG2 PRO A 51 4.184 12.955 10.685 1.00 1.00 H ATOM 835 HG3 PRO A 51 5.009 13.613 12.110 1.00 1.06 H ATOM 836 HD2 PRO A 51 2.548 11.936 11.983 1.00 0.80 H ATOM 837 HD3 PRO A 51 3.727 12.116 13.302 1.00 0.90 H ATOM 838 N ALA A 52 1.299 17.046 12.939 1.00 0.90 N ATOM 839 CA ALA A 52 0.117 17.917 12.717 1.00 0.98 C ATOM 840 C ALA A 52 -0.231 17.934 11.225 1.00 1.05 C ATOM 841 O ALA A 52 0.634 17.844 10.376 1.00 1.61 O ATOM 842 CB ALA A 52 0.458 19.328 13.189 1.00 1.16 C ATOM 843 H ALA A 52 2.063 17.383 13.450 1.00 0.95 H ATOM 844 HA ALA A 52 -0.723 17.540 13.281 1.00 0.94 H ATOM 845 HB1 ALA A 52 1.462 19.575 12.873 1.00 1.56 H ATOM 846 HB2 ALA A 52 -0.240 20.034 12.763 1.00 1.56 H ATOM 847 HB3 ALA A 52 0.401 19.368 14.266 1.00 1.58 H ATOM 848 N GLY A 53 -1.493 18.043 10.899 1.00 0.94 N ATOM 849 CA GLY A 53 -1.907 18.061 9.461 1.00 0.97 C ATOM 850 C GLY A 53 -2.358 16.657 9.049 1.00 0.85 C ATOM 851 O GLY A 53 -3.058 16.478 8.073 1.00 0.88 O ATOM 852 H GLY A 53 -2.172 18.111 11.602 1.00 1.24 H ATOM 853 HA2 GLY A 53 -2.727 18.754 9.334 1.00 1.06 H ATOM 854 HA3 GLY A 53 -1.078 18.367 8.839 1.00 1.02 H ATOM 855 N LYS A 54 -1.961 15.661 9.792 1.00 0.76 N ATOM 856 CA LYS A 54 -2.358 14.263 9.463 1.00 0.67 C ATOM 857 C LYS A 54 -3.707 13.952 10.122 1.00 0.63 C ATOM 858 O LYS A 54 -4.065 14.533 11.127 1.00 0.66 O ATOM 859 CB LYS A 54 -1.286 13.308 10.008 1.00 0.66 C ATOM 860 CG LYS A 54 -0.079 13.238 9.059 1.00 0.88 C ATOM 861 CD LYS A 54 0.351 14.640 8.601 1.00 0.80 C ATOM 862 CE LYS A 54 1.669 14.535 7.829 1.00 0.81 C ATOM 863 NZ LYS A 54 2.204 15.902 7.572 1.00 1.71 N ATOM 864 H LYS A 54 -1.397 15.831 10.575 1.00 0.77 H ATOM 865 HA LYS A 54 -2.446 14.141 8.393 1.00 0.72 H ATOM 866 HB2 LYS A 54 -0.958 13.659 10.975 1.00 0.70 H ATOM 867 HB3 LYS A 54 -1.708 12.320 10.115 1.00 0.61 H ATOM 868 HG2 LYS A 54 0.748 12.773 9.579 1.00 1.42 H ATOM 869 HG3 LYS A 54 -0.338 12.644 8.196 1.00 1.53 H ATOM 870 HD2 LYS A 54 -0.403 15.063 7.953 1.00 1.41 H ATOM 871 HD3 LYS A 54 0.489 15.277 9.461 1.00 1.29 H ATOM 872 HE2 LYS A 54 2.384 13.971 8.407 1.00 1.03 H ATOM 873 HE3 LYS A 54 1.495 14.035 6.888 1.00 1.07 H ATOM 874 HZ1 LYS A 54 1.424 16.536 7.307 1.00 2.19 H ATOM 875 HZ2 LYS A 54 2.666 16.261 8.433 1.00 2.17 H ATOM 876 HZ3 LYS A 54 2.896 15.864 6.797 1.00 2.22 H ATOM 877 N ARG A 55 -4.457 13.040 9.562 1.00 0.60 N ATOM 878 CA ARG A 55 -5.779 12.693 10.156 1.00 0.60 C ATOM 879 C ARG A 55 -5.573 11.724 11.321 1.00 0.58 C ATOM 880 O ARG A 55 -4.945 10.694 11.182 1.00 0.71 O ATOM 881 CB ARG A 55 -6.660 12.030 9.090 1.00 0.65 C ATOM 882 CG ARG A 55 -6.685 12.894 7.799 1.00 0.89 C ATOM 883 CD ARG A 55 -8.119 13.030 7.276 1.00 0.84 C ATOM 884 NE ARG A 55 -8.693 11.676 7.033 1.00 1.73 N ATOM 885 CZ ARG A 55 -9.978 11.534 6.858 1.00 2.45 C ATOM 886 NH1 ARG A 55 -10.760 12.579 6.883 1.00 2.53 N ATOM 887 NH2 ARG A 55 -10.482 10.348 6.654 1.00 3.40 N ATOM 888 H ARG A 55 -4.151 12.585 8.751 1.00 0.61 H ATOM 889 HA ARG A 55 -6.263 13.591 10.511 1.00 0.65 H ATOM 890 HB2 ARG A 55 -6.262 11.049 8.864 1.00 0.87 H ATOM 891 HB3 ARG A 55 -7.662 11.924 9.481 1.00 0.93 H ATOM 892 HG2 ARG A 55 -6.294 13.882 8.005 1.00 1.34 H ATOM 893 HG3 ARG A 55 -6.075 12.425 7.039 1.00 1.52 H ATOM 894 HD2 ARG A 55 -8.718 13.547 8.009 1.00 1.11 H ATOM 895 HD3 ARG A 55 -8.114 13.593 6.354 1.00 1.16 H ATOM 896 HE ARG A 55 -8.105 10.892 7.009 1.00 2.10 H ATOM 897 HH11 ARG A 55 -10.374 13.488 7.036 1.00 2.09 H ATOM 898 HH12 ARG A 55 -11.745 12.470 6.749 1.00 3.26 H ATOM 899 HH21 ARG A 55 -9.883 9.547 6.632 1.00 3.62 H ATOM 900 HH22 ARG A 55 -11.467 10.239 6.521 1.00 4.02 H ATOM 901 N ASP A 56 -6.096 12.049 12.472 1.00 0.61 N ATOM 902 CA ASP A 56 -5.928 11.150 13.647 1.00 0.62 C ATOM 903 C ASP A 56 -6.456 9.755 13.307 1.00 0.59 C ATOM 904 O ASP A 56 -7.289 9.588 12.439 1.00 0.61 O ATOM 905 CB ASP A 56 -6.706 11.720 14.836 1.00 0.73 C ATOM 906 CG ASP A 56 -8.075 12.207 14.363 1.00 1.61 C ATOM 907 OD1 ASP A 56 -8.621 11.595 13.460 1.00 2.40 O ATOM 908 OD2 ASP A 56 -8.553 13.186 14.911 1.00 2.29 O ATOM 909 H ASP A 56 -6.597 12.886 12.563 1.00 0.76 H ATOM 910 HA ASP A 56 -4.881 11.082 13.902 1.00 0.62 H ATOM 911 HB2 ASP A 56 -6.835 10.953 15.586 1.00 1.19 H ATOM 912 HB3 ASP A 56 -6.158 12.549 15.258 1.00 1.32 H ATOM 913 N ALA A 57 -5.974 8.751 13.985 1.00 0.58 N ATOM 914 CA ALA A 57 -6.444 7.368 13.703 1.00 0.58 C ATOM 915 C ALA A 57 -5.948 6.443 14.809 1.00 0.60 C ATOM 916 O ALA A 57 -4.987 6.744 15.489 1.00 0.84 O ATOM 917 CB ALA A 57 -5.865 6.896 12.365 1.00 0.56 C ATOM 918 H ALA A 57 -5.299 8.906 14.683 1.00 0.61 H ATOM 919 HA ALA A 57 -7.522 7.347 13.663 1.00 0.62 H ATOM 920 HB1 ALA A 57 -4.795 7.054 12.360 1.00 1.18 H ATOM 921 HB2 ALA A 57 -6.072 5.843 12.231 1.00 1.16 H ATOM 922 HB3 ALA A 57 -6.315 7.458 11.560 1.00 1.09 H ATOM 923 N ILE A 58 -6.567 5.310 14.987 1.00 0.52 N ATOM 924 CA ILE A 58 -6.080 4.386 16.036 1.00 0.53 C ATOM 925 C ILE A 58 -4.759 3.815 15.556 1.00 0.59 C ATOM 926 O ILE A 58 -4.363 4.016 14.424 1.00 1.01 O ATOM 927 CB ILE A 58 -7.080 3.245 16.253 1.00 0.53 C ATOM 928 CG1 ILE A 58 -7.186 2.384 14.976 1.00 0.56 C ATOM 929 CG2 ILE A 58 -8.453 3.824 16.593 1.00 0.53 C ATOM 930 CD1 ILE A 58 -8.296 1.320 15.110 1.00 0.58 C ATOM 931 H ILE A 58 -7.329 5.062 14.426 1.00 0.59 H ATOM 932 HA ILE A 58 -5.930 4.924 16.963 1.00 0.53 H ATOM 933 HB ILE A 58 -6.741 2.634 17.074 1.00 0.53 H ATOM 934 HG12 ILE A 58 -7.411 3.024 14.136 1.00 0.57 H ATOM 935 HG13 ILE A 58 -6.244 1.886 14.796 1.00 0.58 H ATOM 936 HG21 ILE A 58 -8.339 4.627 17.308 1.00 0.97 H ATOM 937 HG22 ILE A 58 -8.916 4.202 15.691 1.00 1.11 H ATOM 938 HG23 ILE A 58 -9.071 3.043 17.019 1.00 1.18 H ATOM 939 HD11 ILE A 58 -8.738 1.344 16.096 1.00 1.14 H ATOM 940 HD12 ILE A 58 -9.060 1.509 14.370 1.00 1.12 H ATOM 941 HD13 ILE A 58 -7.872 0.342 14.939 1.00 1.18 H ATOM 942 N SER A 59 -4.074 3.101 16.388 1.00 0.42 N ATOM 943 CA SER A 59 -2.784 2.519 15.957 1.00 0.41 C ATOM 944 C SER A 59 -3.061 1.310 15.071 1.00 0.39 C ATOM 945 O SER A 59 -3.990 0.562 15.301 1.00 0.43 O ATOM 946 CB SER A 59 -1.999 2.110 17.193 1.00 0.44 C ATOM 947 OG SER A 59 -2.279 0.753 17.505 1.00 1.16 O ATOM 948 H SER A 59 -4.410 2.943 17.295 1.00 0.62 H ATOM 949 HA SER A 59 -2.226 3.253 15.395 1.00 0.43 H ATOM 950 HB2 SER A 59 -0.944 2.226 17.014 1.00 0.81 H ATOM 951 HB3 SER A 59 -2.299 2.746 18.012 1.00 0.93 H ATOM 952 HG SER A 59 -3.114 0.520 17.094 1.00 1.65 H ATOM 953 N LEU A 60 -2.276 1.127 14.048 1.00 0.41 N ATOM 954 CA LEU A 60 -2.501 -0.021 13.126 1.00 0.42 C ATOM 955 C LEU A 60 -2.762 -1.290 13.942 1.00 0.43 C ATOM 956 O LEU A 60 -3.508 -2.161 13.538 1.00 0.52 O ATOM 957 CB LEU A 60 -1.247 -0.214 12.256 1.00 0.49 C ATOM 958 CG LEU A 60 -1.580 -0.984 10.947 1.00 0.75 C ATOM 959 CD1 LEU A 60 -0.707 -0.465 9.790 1.00 1.06 C ATOM 960 CD2 LEU A 60 -1.320 -2.480 11.149 1.00 1.49 C ATOM 961 H LEU A 60 -1.546 1.756 13.875 1.00 0.48 H ATOM 962 HA LEU A 60 -3.355 0.200 12.505 1.00 0.42 H ATOM 963 HB2 LEU A 60 -0.844 0.755 12.017 1.00 0.48 H ATOM 964 HB3 LEU A 60 -0.503 -0.763 12.819 1.00 0.86 H ATOM 965 HG LEU A 60 -2.617 -0.846 10.684 1.00 1.65 H ATOM 966 HD11 LEU A 60 0.281 -0.233 10.159 1.00 1.51 H ATOM 967 HD12 LEU A 60 -0.636 -1.216 9.017 1.00 1.66 H ATOM 968 HD13 LEU A 60 -1.153 0.429 9.379 1.00 1.71 H ATOM 969 HD21 LEU A 60 -1.737 -2.790 12.095 1.00 2.00 H ATOM 970 HD22 LEU A 60 -1.789 -3.033 10.351 1.00 2.03 H ATOM 971 HD23 LEU A 60 -0.256 -2.669 11.143 1.00 2.04 H ATOM 972 N ARG A 61 -2.145 -1.395 15.086 1.00 0.42 N ATOM 973 CA ARG A 61 -2.343 -2.598 15.938 1.00 0.44 C ATOM 974 C ARG A 61 -3.815 -2.701 16.337 1.00 0.45 C ATOM 975 O ARG A 61 -4.340 -3.779 16.531 1.00 0.47 O ATOM 976 CB ARG A 61 -1.468 -2.472 17.190 1.00 0.46 C ATOM 977 CG ARG A 61 0.011 -2.762 16.834 1.00 0.72 C ATOM 978 CD ARG A 61 0.339 -4.232 17.104 1.00 0.81 C ATOM 979 NE ARG A 61 1.569 -4.628 16.355 1.00 0.57 N ATOM 980 CZ ARG A 61 2.192 -5.728 16.676 1.00 1.27 C ATOM 981 NH1 ARG A 61 1.730 -6.483 17.634 1.00 2.14 N ATOM 982 NH2 ARG A 61 3.274 -6.078 16.037 1.00 1.33 N ATOM 983 H ARG A 61 -1.548 -0.678 15.386 1.00 0.45 H ATOM 984 HA ARG A 61 -2.058 -3.482 15.387 1.00 0.45 H ATOM 985 HB2 ARG A 61 -1.555 -1.468 17.580 1.00 0.42 H ATOM 986 HB3 ARG A 61 -1.809 -3.174 17.939 1.00 0.51 H ATOM 987 HG2 ARG A 61 0.192 -2.539 15.792 1.00 1.40 H ATOM 988 HG3 ARG A 61 0.652 -2.145 17.444 1.00 1.56 H ATOM 989 HD2 ARG A 61 0.510 -4.361 18.163 1.00 1.64 H ATOM 990 HD3 ARG A 61 -0.491 -4.852 16.789 1.00 1.51 H ATOM 991 HE ARG A 61 1.910 -4.063 15.628 1.00 0.58 H ATOM 992 HH11 ARG A 61 0.898 -6.218 18.121 1.00 2.23 H ATOM 993 HH12 ARG A 61 2.205 -7.327 17.879 1.00 2.78 H ATOM 994 HH21 ARG A 61 3.629 -5.504 15.300 1.00 0.95 H ATOM 995 HH22 ARG A 61 3.749 -6.923 16.285 1.00 1.97 H ATOM 996 N GLU A 62 -4.494 -1.590 16.443 1.00 0.45 N ATOM 997 CA GLU A 62 -5.932 -1.643 16.807 1.00 0.48 C ATOM 998 C GLU A 62 -6.716 -2.086 15.571 1.00 0.49 C ATOM 999 O GLU A 62 -7.687 -2.813 15.661 1.00 0.55 O ATOM 1000 CB GLU A 62 -6.393 -0.260 17.257 1.00 0.50 C ATOM 1001 CG GLU A 62 -5.890 0.014 18.675 1.00 0.52 C ATOM 1002 CD GLU A 62 -6.666 -0.856 19.663 1.00 1.24 C ATOM 1003 OE1 GLU A 62 -7.883 -0.775 19.661 1.00 1.90 O ATOM 1004 OE2 GLU A 62 -6.031 -1.589 20.402 1.00 1.97 O ATOM 1005 H GLU A 62 -4.064 -0.725 16.268 1.00 0.45 H ATOM 1006 HA GLU A 62 -6.081 -2.353 17.605 1.00 0.49 H ATOM 1007 HB2 GLU A 62 -5.996 0.482 16.587 1.00 0.49 H ATOM 1008 HB3 GLU A 62 -7.470 -0.221 17.246 1.00 0.56 H ATOM 1009 HG2 GLU A 62 -4.837 -0.222 18.736 1.00 0.97 H ATOM 1010 HG3 GLU A 62 -6.042 1.054 18.918 1.00 1.01 H ATOM 1011 N LYS A 63 -6.279 -1.669 14.411 1.00 0.47 N ATOM 1012 CA LYS A 63 -6.974 -2.079 13.160 1.00 0.49 C ATOM 1013 C LYS A 63 -6.750 -3.574 12.949 1.00 0.48 C ATOM 1014 O LYS A 63 -7.683 -4.337 12.807 1.00 0.57 O ATOM 1015 CB LYS A 63 -6.408 -1.292 11.973 1.00 0.50 C ATOM 1016 CG LYS A 63 -6.622 0.208 12.210 1.00 0.53 C ATOM 1017 CD LYS A 63 -6.505 0.968 10.887 1.00 0.63 C ATOM 1018 CE LYS A 63 -6.806 2.454 11.117 1.00 0.74 C ATOM 1019 NZ LYS A 63 -7.148 3.092 9.816 1.00 1.39 N ATOM 1020 H LYS A 63 -5.482 -1.100 14.364 1.00 0.46 H ATOM 1021 HA LYS A 63 -8.029 -1.884 13.250 1.00 0.53 H ATOM 1022 HB2 LYS A 63 -5.351 -1.496 11.876 1.00 0.52 H ATOM 1023 HB3 LYS A 63 -6.918 -1.590 11.068 1.00 0.56 H ATOM 1024 HG2 LYS A 63 -7.605 0.371 12.627 1.00 0.66 H ATOM 1025 HG3 LYS A 63 -5.874 0.572 12.897 1.00 0.71 H ATOM 1026 HD2 LYS A 63 -5.503 0.859 10.497 1.00 0.80 H ATOM 1027 HD3 LYS A 63 -7.212 0.567 10.177 1.00 0.80 H ATOM 1028 HE2 LYS A 63 -7.640 2.558 11.799 1.00 0.79 H ATOM 1029 HE3 LYS A 63 -5.936 2.937 11.537 1.00 1.07 H ATOM 1030 HZ1 LYS A 63 -6.784 2.507 9.037 1.00 1.94 H ATOM 1031 HZ2 LYS A 63 -8.182 3.176 9.733 1.00 1.93 H ATOM 1032 HZ3 LYS A 63 -6.717 4.036 9.768 1.00 1.70 H ATOM 1033 N ILE A 64 -5.514 -4.000 12.950 1.00 0.43 N ATOM 1034 CA ILE A 64 -5.222 -5.452 12.769 1.00 0.43 C ATOM 1035 C ILE A 64 -6.111 -6.252 13.732 1.00 0.48 C ATOM 1036 O ILE A 64 -6.677 -7.267 13.378 1.00 0.56 O ATOM 1037 CB ILE A 64 -3.723 -5.711 13.058 1.00 0.39 C ATOM 1038 CG1 ILE A 64 -2.916 -5.442 11.783 1.00 0.41 C ATOM 1039 CG2 ILE A 64 -3.491 -7.162 13.503 1.00 0.42 C ATOM 1040 CD1 ILE A 64 -1.417 -5.440 12.094 1.00 0.45 C ATOM 1041 H ILE A 64 -4.781 -3.366 13.083 1.00 0.44 H ATOM 1042 HA ILE A 64 -5.450 -5.733 11.753 1.00 0.45 H ATOM 1043 HB ILE A 64 -3.393 -5.041 13.838 1.00 0.40 H ATOM 1044 HG12 ILE A 64 -3.129 -6.211 11.056 1.00 0.46 H ATOM 1045 HG13 ILE A 64 -3.202 -4.486 11.385 1.00 0.50 H ATOM 1046 HG21 ILE A 64 -4.042 -7.828 12.856 1.00 1.13 H ATOM 1047 HG22 ILE A 64 -2.438 -7.395 13.448 1.00 1.13 H ATOM 1048 HG23 ILE A 64 -3.831 -7.282 14.522 1.00 1.02 H ATOM 1049 HD11 ILE A 64 -1.230 -4.856 12.983 1.00 1.15 H ATOM 1050 HD12 ILE A 64 -1.083 -6.455 12.256 1.00 0.97 H ATOM 1051 HD13 ILE A 64 -0.878 -5.014 11.260 1.00 1.14 H ATOM 1052 N ALA A 65 -6.234 -5.792 14.944 1.00 0.47 N ATOM 1053 CA ALA A 65 -7.083 -6.508 15.936 1.00 0.54 C ATOM 1054 C ALA A 65 -8.495 -6.686 15.373 1.00 0.62 C ATOM 1055 O ALA A 65 -9.155 -7.672 15.633 1.00 0.72 O ATOM 1056 CB ALA A 65 -7.155 -5.690 17.227 1.00 0.53 C ATOM 1057 H ALA A 65 -5.769 -4.970 15.203 1.00 0.44 H ATOM 1058 HA ALA A 65 -6.653 -7.476 16.147 1.00 0.56 H ATOM 1059 HB1 ALA A 65 -6.156 -5.428 17.544 1.00 1.22 H ATOM 1060 HB2 ALA A 65 -7.724 -4.789 17.050 1.00 1.11 H ATOM 1061 HB3 ALA A 65 -7.636 -6.274 17.998 1.00 1.12 H ATOM 1062 N GLU A 66 -8.970 -5.740 14.607 1.00 0.61 N ATOM 1063 CA GLU A 66 -10.344 -5.866 14.042 1.00 0.72 C ATOM 1064 C GLU A 66 -10.347 -6.926 12.941 1.00 0.75 C ATOM 1065 O GLU A 66 -11.275 -7.698 12.805 1.00 0.87 O ATOM 1066 CB GLU A 66 -10.784 -4.522 13.456 1.00 0.74 C ATOM 1067 CG GLU A 66 -10.964 -3.505 14.586 1.00 0.91 C ATOM 1068 CD GLU A 66 -11.675 -2.262 14.049 1.00 1.57 C ATOM 1069 OE1 GLU A 66 -11.088 -1.577 13.227 1.00 2.28 O ATOM 1070 OE2 GLU A 66 -12.794 -2.016 14.468 1.00 2.12 O ATOM 1071 H GLU A 66 -8.425 -4.947 14.404 1.00 0.56 H ATOM 1072 HA GLU A 66 -11.027 -6.158 14.826 1.00 0.81 H ATOM 1073 HB2 GLU A 66 -10.032 -4.166 12.766 1.00 0.85 H ATOM 1074 HB3 GLU A 66 -11.722 -4.645 12.934 1.00 0.86 H ATOM 1075 HG2 GLU A 66 -11.556 -3.946 15.376 1.00 1.28 H ATOM 1076 HG3 GLU A 66 -9.997 -3.224 14.975 1.00 1.23 H ATOM 1077 N LEU A 67 -9.312 -6.962 12.154 1.00 0.67 N ATOM 1078 CA LEU A 67 -9.238 -7.961 11.053 1.00 0.73 C ATOM 1079 C LEU A 67 -9.094 -9.368 11.638 1.00 0.84 C ATOM 1080 O LEU A 67 -9.522 -10.341 11.048 1.00 1.02 O ATOM 1081 CB LEU A 67 -8.029 -7.644 10.175 1.00 0.66 C ATOM 1082 CG LEU A 67 -7.958 -6.136 9.931 1.00 0.60 C ATOM 1083 CD1 LEU A 67 -6.814 -5.838 8.966 1.00 0.61 C ATOM 1084 CD2 LEU A 67 -9.279 -5.649 9.325 1.00 0.71 C ATOM 1085 H LEU A 67 -8.579 -6.326 12.286 1.00 0.59 H ATOM 1086 HA LEU A 67 -10.137 -7.910 10.458 1.00 0.81 H ATOM 1087 HB2 LEU A 67 -7.126 -7.971 10.671 1.00 0.64 H ATOM 1088 HB3 LEU A 67 -8.125 -8.156 9.229 1.00 0.72 H ATOM 1089 HG LEU A 67 -7.779 -5.627 10.868 1.00 0.55 H ATOM 1090 HD11 LEU A 67 -6.883 -6.500 8.117 1.00 1.22 H ATOM 1091 HD12 LEU A 67 -6.881 -4.814 8.633 1.00 1.22 H ATOM 1092 HD13 LEU A 67 -5.870 -5.994 9.467 1.00 1.13 H ATOM 1093 HD21 LEU A 67 -9.594 -6.332 8.549 1.00 1.19 H ATOM 1094 HD22 LEU A 67 -10.034 -5.605 10.095 1.00 1.20 H ATOM 1095 HD23 LEU A 67 -9.140 -4.664 8.903 1.00 1.25 H ATOM 1096 N GLN A 68 -8.496 -9.486 12.791 1.00 0.79 N ATOM 1097 CA GLN A 68 -8.329 -10.832 13.404 1.00 0.93 C ATOM 1098 C GLN A 68 -9.643 -11.251 14.060 1.00 1.09 C ATOM 1099 O GLN A 68 -10.031 -12.402 14.023 1.00 1.41 O ATOM 1100 CB GLN A 68 -7.230 -10.781 14.468 1.00 0.88 C ATOM 1101 CG GLN A 68 -5.865 -10.638 13.793 1.00 1.25 C ATOM 1102 CD GLN A 68 -4.763 -10.775 14.844 1.00 1.55 C ATOM 1103 OE1 GLN A 68 -4.917 -11.491 15.814 1.00 2.12 O ATOM 1104 NE2 GLN A 68 -3.649 -10.115 14.692 1.00 2.03 N ATOM 1105 H GLN A 68 -8.157 -8.690 13.252 1.00 0.70 H ATOM 1106 HA GLN A 68 -8.061 -11.549 12.640 1.00 1.03 H ATOM 1107 HB2 GLN A 68 -7.400 -9.937 15.120 1.00 1.19 H ATOM 1108 HB3 GLN A 68 -7.248 -11.692 15.047 1.00 1.19 H ATOM 1109 HG2 GLN A 68 -5.750 -11.410 13.046 1.00 1.77 H ATOM 1110 HG3 GLN A 68 -5.795 -9.668 13.325 1.00 1.82 H ATOM 1111 HE21 GLN A 68 -3.525 -9.537 13.911 1.00 2.29 H ATOM 1112 HE22 GLN A 68 -2.936 -10.196 15.360 1.00 2.50 H ATOM 1113 N LYS A 69 -10.332 -10.324 14.664 1.00 1.17 N ATOM 1114 CA LYS A 69 -11.620 -10.665 15.324 1.00 1.39 C ATOM 1115 C LYS A 69 -12.697 -10.882 14.260 1.00 1.50 C ATOM 1116 O LYS A 69 -12.837 -11.963 13.725 1.00 1.93 O ATOM 1117 CB LYS A 69 -12.021 -9.524 16.265 1.00 1.36 C ATOM 1118 CG LYS A 69 -11.179 -9.608 17.545 1.00 1.65 C ATOM 1119 CD LYS A 69 -11.274 -8.295 18.328 1.00 1.72 C ATOM 1120 CE LYS A 69 -10.707 -8.503 19.735 1.00 2.40 C ATOM 1121 NZ LYS A 69 -11.690 -9.260 20.559 1.00 2.90 N ATOM 1122 H LYS A 69 -10.001 -9.401 14.683 1.00 1.28 H ATOM 1123 HA LYS A 69 -11.497 -11.575 15.894 1.00 1.66 H ATOM 1124 HB2 LYS A 69 -11.845 -8.576 15.777 1.00 1.57 H ATOM 1125 HB3 LYS A 69 -13.067 -9.613 16.516 1.00 1.85 H ATOM 1126 HG2 LYS A 69 -11.544 -10.418 18.160 1.00 2.16 H ATOM 1127 HG3 LYS A 69 -10.147 -9.794 17.286 1.00 1.98 H ATOM 1128 HD2 LYS A 69 -10.705 -7.530 17.819 1.00 1.68 H ATOM 1129 HD3 LYS A 69 -12.307 -7.990 18.399 1.00 1.95 H ATOM 1130 HE2 LYS A 69 -9.784 -9.061 19.674 1.00 2.77 H ATOM 1131 HE3 LYS A 69 -10.517 -7.543 20.193 1.00 2.89 H ATOM 1132 HZ1 LYS A 69 -12.092 -10.035 19.993 1.00 3.27 H ATOM 1133 HZ2 LYS A 69 -11.213 -9.655 21.393 1.00 3.27 H ATOM 1134 HZ3 LYS A 69 -12.452 -8.620 20.863 1.00 3.19 H ATOM 1135 N ASP A 70 -13.464 -9.870 13.945 1.00 1.51 N ATOM 1136 CA ASP A 70 -14.528 -10.043 12.911 1.00 1.73 C ATOM 1137 C ASP A 70 -14.901 -8.690 12.304 1.00 1.73 C ATOM 1138 O ASP A 70 -15.048 -8.557 11.105 1.00 2.49 O ATOM 1139 CB ASP A 70 -15.767 -10.669 13.555 1.00 2.42 C ATOM 1140 CG ASP A 70 -16.718 -11.160 12.463 1.00 3.06 C ATOM 1141 OD1 ASP A 70 -16.570 -10.725 11.333 1.00 3.49 O ATOM 1142 OD2 ASP A 70 -17.583 -11.963 12.776 1.00 3.70 O ATOM 1143 H ASP A 70 -13.340 -9.004 14.387 1.00 1.63 H ATOM 1144 HA ASP A 70 -14.165 -10.692 12.129 1.00 1.97 H ATOM 1145 HB2 ASP A 70 -15.468 -11.501 14.176 1.00 2.93 H ATOM 1146 HB3 ASP A 70 -16.268 -9.929 14.161 1.00 2.64 H ATOM 1147 N ILE A 71 -15.067 -7.687 13.120 1.00 1.73 N ATOM 1148 CA ILE A 71 -15.444 -6.343 12.587 1.00 2.41 C ATOM 1149 C ILE A 71 -14.898 -5.252 13.515 1.00 3.12 C ATOM 1150 O ILE A 71 -13.818 -5.372 14.060 1.00 3.63 O ATOM 1151 CB ILE A 71 -16.970 -6.247 12.502 1.00 3.08 C ATOM 1152 CG1 ILE A 71 -17.364 -4.986 11.727 1.00 3.45 C ATOM 1153 CG2 ILE A 71 -17.562 -6.194 13.912 1.00 3.83 C ATOM 1154 CD1 ILE A 71 -18.879 -4.969 11.510 1.00 4.05 C ATOM 1155 H ILE A 71 -14.950 -7.817 14.083 1.00 1.89 H ATOM 1156 HA ILE A 71 -15.024 -6.213 11.599 1.00 2.72 H ATOM 1157 HB ILE A 71 -17.353 -7.118 11.988 1.00 3.51 H ATOM 1158 HG12 ILE A 71 -17.068 -4.112 12.287 1.00 3.66 H ATOM 1159 HG13 ILE A 71 -16.867 -4.986 10.767 1.00 3.76 H ATOM 1160 HG21 ILE A 71 -17.084 -6.942 14.525 1.00 4.11 H ATOM 1161 HG22 ILE A 71 -17.392 -5.216 14.336 1.00 4.30 H ATOM 1162 HG23 ILE A 71 -18.624 -6.392 13.868 1.00 4.13 H ATOM 1163 HD11 ILE A 71 -19.203 -5.941 11.166 1.00 4.43 H ATOM 1164 HD12 ILE A 71 -19.375 -4.731 12.440 1.00 4.14 H ATOM 1165 HD13 ILE A 71 -19.124 -4.225 10.769 1.00 4.51 H TER 1166 ILE A 71 ATOM 1167 O5' DG B 101 -2.075 -15.300 0.473 1.00 0.76 O ATOM 1168 C5' DG B 101 -1.603 -15.582 1.793 1.00 0.77 C ATOM 1169 C4' DG B 101 -0.067 -15.626 1.849 1.00 0.70 C ATOM 1170 O4' DG B 101 0.461 -16.135 0.603 1.00 0.69 O ATOM 1171 C3' DG B 101 0.574 -14.249 2.103 1.00 0.63 C ATOM 1172 O3' DG B 101 1.232 -14.220 3.371 1.00 0.65 O ATOM 1173 C2' DG B 101 1.578 -14.057 0.986 1.00 0.57 C ATOM 1174 C1' DG B 101 1.604 -15.359 0.198 1.00 0.62 C ATOM 1175 N9 DG B 101 1.602 -15.099 -1.255 1.00 0.60 N ATOM 1176 C8 DG B 101 0.581 -14.684 -2.062 1.00 0.60 C ATOM 1177 N7 DG B 101 0.897 -14.529 -3.315 1.00 0.59 N ATOM 1178 C5 DG B 101 2.249 -14.870 -3.347 1.00 0.62 C ATOM 1179 C6 DG B 101 3.160 -14.897 -4.441 1.00 0.70 C ATOM 1180 O6 DG B 101 2.947 -14.618 -5.619 1.00 0.70 O ATOM 1181 N1 DG B 101 4.428 -15.300 -4.037 1.00 0.86 N ATOM 1182 C2 DG B 101 4.779 -15.635 -2.747 1.00 0.90 C ATOM 1183 N2 DG B 101 6.044 -16.004 -2.556 1.00 1.11 N ATOM 1184 N3 DG B 101 3.927 -15.611 -1.719 1.00 0.79 N ATOM 1185 C4 DG B 101 2.686 -15.221 -2.090 1.00 0.65 C ATOM 1186 H5' DG B 101 -1.998 -16.551 2.103 1.00 0.96 H ATOM 1187 H5'' DG B 101 -1.972 -14.819 2.477 1.00 0.74 H ATOM 1188 H4' DG B 101 0.234 -16.296 2.651 1.00 0.73 H ATOM 1189 H3' DG B 101 -0.173 -13.456 2.070 1.00 0.64 H ATOM 1190 H2' DG B 101 1.272 -13.237 0.333 1.00 0.54 H ATOM 1191 H2'' DG B 101 2.564 -13.847 1.407 1.00 0.56 H ATOM 1192 H1' DG B 101 2.503 -15.914 0.452 1.00 0.65 H ATOM 1193 H8 DG B 101 -0.424 -14.497 -1.685 1.00 0.66 H ATOM 1194 H1 DG B 101 5.133 -15.341 -4.760 1.00 0.97 H ATOM 1195 H21 DG B 101 6.688 -16.023 -3.334 1.00 1.21 H ATOM 1196 H22 DG B 101 6.360 -16.264 -1.633 1.00 1.16 H ATOM 1197 HO5' DG B 101 -2.518 -16.089 0.153 1.00 1.01 H ATOM 1198 P DA B 102 1.550 -12.815 4.092 1.00 0.63 P ATOM 1199 OP1 DA B 102 1.781 -13.074 5.531 1.00 0.76 O ATOM 1200 OP2 DA B 102 0.520 -11.839 3.675 1.00 0.68 O ATOM 1201 O5' DA B 102 2.951 -12.384 3.426 1.00 0.50 O ATOM 1202 C5' DA B 102 4.187 -12.664 4.088 1.00 0.63 C ATOM 1203 C4' DA B 102 5.281 -11.665 3.697 1.00 0.55 C ATOM 1204 O4' DA B 102 5.624 -11.822 2.302 1.00 0.53 O ATOM 1205 C3' DA B 102 4.849 -10.209 3.922 1.00 0.48 C ATOM 1206 O3' DA B 102 5.830 -9.527 4.723 1.00 0.51 O ATOM 1207 C2' DA B 102 4.742 -9.605 2.534 1.00 0.40 C ATOM 1208 C1' DA B 102 5.384 -10.598 1.577 1.00 0.43 C ATOM 1209 N9 DA B 102 4.513 -10.843 0.417 1.00 0.40 N ATOM 1210 C8 DA B 102 3.225 -11.279 0.392 1.00 0.41 C ATOM 1211 N7 DA B 102 2.706 -11.395 -0.798 1.00 0.41 N ATOM 1212 C5 DA B 102 3.752 -10.998 -1.636 1.00 0.38 C ATOM 1213 C6 DA B 102 3.873 -10.887 -3.031 1.00 0.37 C ATOM 1214 N6 DA B 102 2.887 -11.176 -3.881 1.00 0.39 N ATOM 1215 N1 DA B 102 5.053 -10.463 -3.516 1.00 0.37 N ATOM 1216 C2 DA B 102 6.054 -10.165 -2.688 1.00 0.39 C ATOM 1217 N3 DA B 102 6.045 -10.235 -1.363 1.00 0.39 N ATOM 1218 C4 DA B 102 4.852 -10.662 -0.901 1.00 0.38 C ATOM 1219 H5' DA B 102 4.513 -13.669 3.821 1.00 0.80 H ATOM 1220 H5'' DA B 102 4.032 -12.616 5.165 1.00 0.82 H ATOM 1221 H4' DA B 102 6.168 -11.863 4.299 1.00 0.59 H ATOM 1222 H3' DA B 102 3.876 -10.166 4.422 1.00 0.50 H ATOM 1223 H2' DA B 102 3.694 -9.461 2.264 1.00 0.39 H ATOM 1224 H2'' DA B 102 5.262 -8.652 2.491 1.00 0.39 H ATOM 1225 H1' DA B 102 6.337 -10.201 1.227 1.00 0.44 H ATOM 1226 H8 DA B 102 2.672 -11.509 1.307 1.00 0.44 H ATOM 1227 H61 DA B 102 3.033 -11.075 -4.877 1.00 0.40 H ATOM 1228 H62 DA B 102 1.994 -11.495 -3.530 1.00 0.42 H ATOM 1229 H2 DA B 102 6.982 -9.826 -3.149 1.00 0.42 H ATOM 1230 P DG B 103 5.785 -7.930 4.953 1.00 0.51 P ATOM 1231 OP1 DG B 103 6.783 -7.583 5.989 1.00 0.63 O ATOM 1232 OP2 DG B 103 4.376 -7.518 5.120 1.00 0.53 O ATOM 1233 O5' DG B 103 6.305 -7.361 3.540 1.00 0.45 O ATOM 1234 C5' DG B 103 7.623 -7.658 3.069 1.00 0.47 C ATOM 1235 C4' DG B 103 8.070 -6.648 2.006 1.00 0.46 C ATOM 1236 O4' DG B 103 7.665 -7.089 0.686 1.00 0.44 O ATOM 1237 C3' DG B 103 7.464 -5.257 2.249 1.00 0.44 C ATOM 1238 O3' DG B 103 8.504 -4.276 2.366 1.00 0.50 O ATOM 1239 C2' DG B 103 6.589 -4.988 1.040 1.00 0.41 C ATOM 1240 C1' DG B 103 6.962 -6.031 0.000 1.00 0.39 C ATOM 1241 N9 DG B 103 5.765 -6.541 -0.704 1.00 0.34 N ATOM 1242 C8 DG B 103 4.614 -7.073 -0.193 1.00 0.33 C ATOM 1243 N7 DG B 103 3.730 -7.430 -1.077 1.00 0.34 N ATOM 1244 C5 DG B 103 4.341 -7.109 -2.288 1.00 0.33 C ATOM 1245 C6 DG B 103 3.866 -7.265 -3.620 1.00 0.35 C ATOM 1246 O6 DG B 103 2.790 -7.725 -3.998 1.00 0.39 O ATOM 1247 N1 DG B 103 4.796 -6.814 -4.548 1.00 0.36 N ATOM 1248 C2 DG B 103 6.030 -6.279 -4.237 1.00 0.38 C ATOM 1249 N2 DG B 103 6.787 -5.899 -5.265 1.00 0.44 N ATOM 1250 N3 DG B 103 6.478 -6.131 -2.988 1.00 0.38 N ATOM 1251 C4 DG B 103 5.586 -6.565 -2.068 1.00 0.34 C ATOM 1252 H5' DG B 103 7.628 -8.658 2.635 1.00 0.50 H ATOM 1253 H5'' DG B 103 8.317 -7.631 3.911 1.00 0.53 H ATOM 1254 H4' DG B 103 9.158 -6.567 2.029 1.00 0.51 H ATOM 1255 H3' DG B 103 6.858 -5.250 3.161 1.00 0.43 H ATOM 1256 H2' DG B 103 5.535 -5.092 1.304 1.00 0.39 H ATOM 1257 H2'' DG B 103 6.774 -3.989 0.655 1.00 0.46 H ATOM 1258 H1' DG B 103 7.636 -5.579 -0.732 1.00 0.44 H ATOM 1259 H8 DG B 103 4.444 -7.183 0.876 1.00 0.34 H ATOM 1260 H1 DG B 103 4.529 -6.892 -5.519 1.00 0.39 H ATOM 1261 H21 DG B 103 6.449 -6.009 -6.210 1.00 0.45 H ATOM 1262 H22 DG B 103 7.700 -5.500 -5.099 1.00 0.48 H ATOM 1263 P DT B 104 8.161 -2.706 2.493 1.00 0.55 P ATOM 1264 OP1 DT B 104 9.043 -2.119 3.527 1.00 0.68 O ATOM 1265 OP2 DT B 104 6.693 -2.559 2.604 1.00 0.54 O ATOM 1266 O5' DT B 104 8.618 -2.138 1.055 1.00 0.52 O ATOM 1267 C5' DT B 104 9.626 -2.819 0.300 1.00 0.52 C ATOM 1268 C4' DT B 104 9.771 -2.242 -1.116 1.00 0.48 C ATOM 1269 O4' DT B 104 8.899 -2.938 -2.036 1.00 0.45 O ATOM 1270 C3' DT B 104 9.435 -0.746 -1.177 1.00 0.49 C ATOM 1271 O3' DT B 104 10.591 0.014 -1.546 1.00 0.52 O ATOM 1272 C2' DT B 104 8.351 -0.614 -2.223 1.00 0.45 C ATOM 1273 C1' DT B 104 8.128 -2.000 -2.816 1.00 0.43 C ATOM 1274 N1 DT B 104 6.686 -2.373 -2.806 1.00 0.42 N ATOM 1275 C2 DT B 104 6.075 -2.687 -4.013 1.00 0.44 C ATOM 1276 O2 DT B 104 6.682 -2.651 -5.081 1.00 0.48 O ATOM 1277 N3 DT B 104 4.741 -3.043 -3.946 1.00 0.45 N ATOM 1278 C4 DT B 104 3.972 -3.111 -2.798 1.00 0.44 C ATOM 1279 O4 DT B 104 2.790 -3.444 -2.855 1.00 0.47 O ATOM 1280 C5 DT B 104 4.688 -2.766 -1.591 1.00 0.43 C ATOM 1281 C7 DT B 104 3.949 -2.787 -0.253 1.00 0.47 C ATOM 1282 C6 DT B 104 5.993 -2.417 -1.632 1.00 0.43 C ATOM 1283 H5' DT B 104 9.360 -3.873 0.226 1.00 0.52 H ATOM 1284 H5'' DT B 104 10.579 -2.730 0.825 1.00 0.58 H ATOM 1285 H4' DT B 104 10.802 -2.379 -1.447 1.00 0.50 H ATOM 1286 H3' DT B 104 9.062 -0.388 -0.213 1.00 0.51 H ATOM 1287 H2' DT B 104 7.430 -0.254 -1.765 1.00 0.45 H ATOM 1288 H2'' DT B 104 8.677 0.080 -2.999 1.00 0.45 H ATOM 1289 H1' DT B 104 8.501 -2.006 -3.838 1.00 0.44 H ATOM 1290 H3 DT B 104 4.285 -3.276 -4.816 1.00 0.49 H ATOM 1291 H71 DT B 104 3.471 -1.821 -0.088 1.00 1.11 H ATOM 1292 H72 DT B 104 4.654 -2.986 0.555 1.00 1.04 H ATOM 1293 H73 DT B 104 3.189 -3.569 -0.272 1.00 1.12 H ATOM 1294 H6 DT B 104 6.508 -2.159 -0.712 1.00 0.45 H ATOM 1295 P DA B 105 10.497 1.608 -1.763 1.00 0.56 P ATOM 1296 OP1 DA B 105 11.871 2.134 -1.931 1.00 0.63 O ATOM 1297 OP2 DA B 105 9.616 2.168 -0.713 1.00 0.60 O ATOM 1298 O5' DA B 105 9.734 1.729 -3.178 1.00 0.51 O ATOM 1299 C5' DA B 105 10.433 1.489 -4.404 1.00 0.49 C ATOM 1300 C4' DA B 105 9.573 1.838 -5.624 1.00 0.45 C ATOM 1301 O4' DA B 105 8.435 0.950 -5.709 1.00 0.43 O ATOM 1302 C3' DA B 105 9.051 3.282 -5.573 1.00 0.47 C ATOM 1303 O3' DA B 105 9.515 4.020 -6.712 1.00 0.51 O ATOM 1304 C2' DA B 105 7.539 3.166 -5.584 1.00 0.46 C ATOM 1305 C1' DA B 105 7.215 1.706 -5.857 1.00 0.42 C ATOM 1306 N9 DA B 105 6.174 1.219 -4.932 1.00 0.40 N ATOM 1307 C8 DA B 105 6.167 1.219 -3.568 1.00 0.43 C ATOM 1308 N7 DA B 105 5.098 0.719 -3.023 1.00 0.44 N ATOM 1309 C5 DA B 105 4.325 0.353 -4.124 1.00 0.39 C ATOM 1310 C6 DA B 105 3.062 -0.239 -4.242 1.00 0.39 C ATOM 1311 N6 DA B 105 2.323 -0.593 -3.191 1.00 0.43 N ATOM 1312 N1 DA B 105 2.595 -0.459 -5.484 1.00 0.38 N ATOM 1313 C2 DA B 105 3.325 -0.119 -6.547 1.00 0.40 C ATOM 1314 N3 DA B 105 4.529 0.445 -6.545 1.00 0.40 N ATOM 1315 C4 DA B 105 4.972 0.654 -5.289 1.00 0.38 C ATOM 1316 H5' DA B 105 10.711 0.436 -4.455 1.00 0.56 H ATOM 1317 H5'' DA B 105 11.338 2.096 -4.422 1.00 0.53 H ATOM 1318 H4' DA B 105 10.178 1.718 -6.522 1.00 0.47 H ATOM 1319 H3' DA B 105 9.381 3.782 -4.657 1.00 0.50 H ATOM 1320 H2' DA B 105 7.129 3.457 -4.617 1.00 0.48 H ATOM 1321 H2'' DA B 105 7.120 3.798 -6.364 1.00 0.51 H ATOM 1322 H1' DA B 105 6.857 1.600 -6.882 1.00 0.45 H ATOM 1323 H8 DA B 105 6.993 1.616 -2.979 1.00 0.48 H ATOM 1324 H61 DA B 105 1.418 -1.018 -3.331 1.00 0.44 H ATOM 1325 H62 DA B 105 2.668 -0.437 -2.255 1.00 0.48 H ATOM 1326 H2 DA B 105 2.887 -0.324 -7.523 1.00 0.45 H ATOM 1327 P DG B 106 9.035 5.538 -6.976 1.00 0.58 P ATOM 1328 OP1 DG B 106 9.928 6.134 -7.995 1.00 0.66 O ATOM 1329 OP2 DG B 106 8.862 6.205 -5.667 1.00 0.64 O ATOM 1330 O5' DG B 106 7.577 5.337 -7.637 1.00 0.52 O ATOM 1331 C5' DG B 106 7.426 4.591 -8.848 1.00 0.49 C ATOM 1332 C4' DG B 106 5.992 4.664 -9.394 1.00 0.47 C ATOM 1333 O4' DG B 106 5.162 3.657 -8.768 1.00 0.44 O ATOM 1334 C3' DG B 106 5.341 6.033 -9.143 1.00 0.49 C ATOM 1335 O3' DG B 106 5.115 6.726 -10.374 1.00 0.54 O ATOM 1336 C2' DG B 106 4.019 5.737 -8.464 1.00 0.47 C ATOM 1337 C1' DG B 106 3.890 4.222 -8.389 1.00 0.44 C ATOM 1338 N9 DG B 106 3.494 3.804 -7.029 1.00 0.42 N ATOM 1339 C8 DG B 106 4.106 4.060 -5.837 1.00 0.44 C ATOM 1340 N7 DG B 106 3.500 3.585 -4.790 1.00 0.45 N ATOM 1341 C5 DG B 106 2.381 2.954 -5.329 1.00 0.43 C ATOM 1342 C6 DG B 106 1.331 2.250 -4.679 1.00 0.44 C ATOM 1343 O6 DG B 106 1.182 2.042 -3.477 1.00 0.47 O ATOM 1344 N1 DG B 106 0.399 1.771 -5.591 1.00 0.43 N ATOM 1345 C2 DG B 106 0.466 1.945 -6.958 1.00 0.43 C ATOM 1346 N2 DG B 106 -0.525 1.410 -7.671 1.00 0.46 N ATOM 1347 N3 DG B 106 1.451 2.607 -7.572 1.00 0.42 N ATOM 1348 C4 DG B 106 2.370 3.082 -6.700 1.00 0.41 C ATOM 1349 H5' DG B 106 7.679 3.548 -8.655 1.00 0.51 H ATOM 1350 H5'' DG B 106 8.113 4.989 -9.596 1.00 0.51 H ATOM 1351 H4' DG B 106 6.015 4.479 -10.468 1.00 0.49 H ATOM 1352 H3' DG B 106 5.969 6.647 -8.489 1.00 0.51 H ATOM 1353 H2' DG B 106 4.004 6.160 -7.457 1.00 0.48 H ATOM 1354 H2'' DG B 106 3.201 6.156 -9.051 1.00 0.49 H ATOM 1355 H1' DG B 106 3.130 3.885 -9.099 1.00 0.45 H ATOM 1356 H8 DG B 106 5.029 4.632 -5.768 1.00 0.47 H ATOM 1357 H1 DG B 106 -0.382 1.262 -5.202 1.00 0.46 H ATOM 1358 H21 DG B 106 -1.269 0.910 -7.206 1.00 0.48 H ATOM 1359 H22 DG B 106 -0.531 1.504 -8.677 1.00 0.48 H ATOM 1360 P DT B 107 4.374 8.157 -10.381 1.00 0.60 P ATOM 1361 OP1 DT B 107 4.626 8.802 -11.689 1.00 0.68 O ATOM 1362 OP2 DT B 107 4.725 8.866 -9.130 1.00 0.61 O ATOM 1363 O5' DT B 107 2.816 7.749 -10.310 1.00 0.59 O ATOM 1364 C5' DT B 107 2.149 7.242 -11.469 1.00 0.62 C ATOM 1365 C4' DT B 107 0.852 6.497 -11.108 1.00 0.58 C ATOM 1366 O4' DT B 107 0.979 5.821 -9.839 1.00 0.52 O ATOM 1367 C3' DT B 107 -0.364 7.429 -11.015 1.00 0.60 C ATOM 1368 O3' DT B 107 -1.205 7.286 -12.164 1.00 0.65 O ATOM 1369 C2' DT B 107 -1.097 7.008 -9.755 1.00 0.53 C ATOM 1370 C1' DT B 107 -0.271 5.894 -9.120 1.00 0.49 C ATOM 1371 N1 DT B 107 -0.043 6.164 -7.678 1.00 0.46 N ATOM 1372 C2 DT B 107 -0.873 5.542 -6.756 1.00 0.42 C ATOM 1373 O2 DT B 107 -1.779 4.786 -7.099 1.00 0.43 O ATOM 1374 N3 DT B 107 -0.623 5.822 -5.427 1.00 0.41 N ATOM 1375 C4 DT B 107 0.368 6.656 -4.942 1.00 0.43 C ATOM 1376 O4 DT B 107 0.501 6.832 -3.732 1.00 0.44 O ATOM 1377 C5 DT B 107 1.182 7.260 -5.974 1.00 0.47 C ATOM 1378 C7 DT B 107 2.317 8.202 -5.580 1.00 0.51 C ATOM 1379 C6 DT B 107 0.957 7.003 -7.279 1.00 0.47 C ATOM 1380 H5' DT B 107 2.822 6.555 -11.986 1.00 0.63 H ATOM 1381 H5'' DT B 107 1.916 8.073 -12.137 1.00 0.69 H ATOM 1382 H4' DT B 107 0.653 5.750 -11.879 1.00 0.60 H ATOM 1383 H3' DT B 107 -0.042 8.471 -10.927 1.00 0.63 H ATOM 1384 H2' DT B 107 -1.178 7.848 -9.062 1.00 0.53 H ATOM 1385 H2'' DT B 107 -2.094 6.644 -10.011 1.00 0.53 H ATOM 1386 H1' DT B 107 -0.790 4.943 -9.237 1.00 0.48 H ATOM 1387 H3 DT B 107 -1.218 5.375 -4.746 1.00 0.39 H ATOM 1388 H71 DT B 107 3.261 7.656 -5.589 1.00 1.09 H ATOM 1389 H72 DT B 107 2.134 8.595 -4.580 1.00 1.13 H ATOM 1390 H73 DT B 107 2.368 9.026 -6.291 1.00 1.10 H ATOM 1391 H6 DT B 107 1.579 7.477 -8.034 1.00 0.51 H ATOM 1392 P DA B 108 -2.527 8.192 -12.330 1.00 0.78 P ATOM 1393 OP1 DA B 108 -2.903 8.203 -13.762 1.00 0.91 O ATOM 1394 OP2 DA B 108 -2.305 9.469 -11.616 1.00 0.83 O ATOM 1395 O5' DA B 108 -3.638 7.348 -11.523 1.00 0.84 O ATOM 1396 C5' DA B 108 -4.756 6.766 -12.204 1.00 0.77 C ATOM 1397 C4' DA B 108 -6.038 6.872 -11.370 1.00 0.67 C ATOM 1398 O4' DA B 108 -5.773 6.487 -10.001 1.00 0.61 O ATOM 1399 C3' DA B 108 -6.613 8.297 -11.366 1.00 0.65 C ATOM 1400 O3' DA B 108 -7.943 8.308 -11.900 1.00 0.65 O ATOM 1401 C2' DA B 108 -6.615 8.732 -9.915 1.00 0.58 C ATOM 1402 C1' DA B 108 -6.091 7.562 -9.094 1.00 0.55 C ATOM 1403 N9 DA B 108 -4.901 7.957 -8.315 1.00 0.53 N ATOM 1404 C8 DA B 108 -3.742 8.540 -8.742 1.00 0.56 C ATOM 1405 N7 DA B 108 -2.866 8.772 -7.809 1.00 0.55 N ATOM 1406 C5 DA B 108 -3.499 8.302 -6.659 1.00 0.50 C ATOM 1407 C6 DA B 108 -3.112 8.250 -5.314 1.00 0.48 C ATOM 1408 N6 DA B 108 -1.935 8.699 -4.875 1.00 0.49 N ATOM 1409 N1 DA B 108 -3.983 7.720 -4.439 1.00 0.45 N ATOM 1410 C2 DA B 108 -5.165 7.267 -4.858 1.00 0.45 C ATOM 1411 N3 DA B 108 -5.628 7.268 -6.103 1.00 0.47 N ATOM 1412 C4 DA B 108 -4.736 7.805 -6.959 1.00 0.50 C ATOM 1413 H5' DA B 108 -4.545 5.715 -12.397 1.00 0.85 H ATOM 1414 H5'' DA B 108 -4.906 7.279 -13.155 1.00 0.77 H ATOM 1415 H4' DA B 108 -6.784 6.195 -11.786 1.00 0.70 H ATOM 1416 H3' DA B 108 -5.984 8.971 -11.956 1.00 0.70 H ATOM 1417 H2' DA B 108 -5.967 9.600 -9.777 1.00 0.59 H ATOM 1418 H2'' DA B 108 -7.632 8.977 -9.607 1.00 0.56 H ATOM 1419 H1' DA B 108 -6.869 7.229 -8.404 1.00 0.52 H ATOM 1420 H8 DA B 108 -3.564 8.791 -9.788 1.00 0.60 H ATOM 1421 H61 DA B 108 -1.706 8.638 -3.893 1.00 0.48 H ATOM 1422 H62 DA B 108 -1.273 9.100 -5.525 1.00 0.53 H ATOM 1423 H2 DA B 108 -5.823 6.850 -4.096 1.00 0.45 H ATOM 1424 P DA B 109 -8.839 9.649 -11.856 1.00 0.65 P ATOM 1425 OP1 DA B 109 -10.058 9.418 -12.663 1.00 0.69 O ATOM 1426 OP2 DA B 109 -7.962 10.803 -12.157 1.00 0.70 O ATOM 1427 O5' DA B 109 -9.270 9.732 -10.303 1.00 0.59 O ATOM 1428 C5' DA B 109 -10.289 8.868 -9.790 1.00 0.57 C ATOM 1429 C4' DA B 109 -10.511 9.058 -8.283 1.00 0.54 C ATOM 1430 O4' DA B 109 -9.290 8.835 -7.542 1.00 0.56 O ATOM 1431 C3' DA B 109 -11.017 10.463 -7.937 1.00 0.49 C ATOM 1432 O3' DA B 109 -12.410 10.435 -7.607 1.00 0.50 O ATOM 1433 C2' DA B 109 -10.189 10.906 -6.745 1.00 0.49 C ATOM 1434 C1' DA B 109 -9.190 9.788 -6.463 1.00 0.52 C ATOM 1435 N9 DA B 109 -7.820 10.325 -6.351 1.00 0.52 N ATOM 1436 C8 DA B 109 -7.007 10.823 -7.326 1.00 0.54 C ATOM 1437 N7 DA B 109 -5.844 11.235 -6.919 1.00 0.56 N ATOM 1438 C5 DA B 109 -5.887 10.990 -5.548 1.00 0.55 C ATOM 1439 C6 DA B 109 -4.964 11.201 -4.519 1.00 0.57 C ATOM 1440 N6 DA B 109 -3.758 11.733 -4.719 1.00 0.62 N ATOM 1441 N1 DA B 109 -5.330 10.844 -3.276 1.00 0.57 N ATOM 1442 C2 DA B 109 -6.533 10.311 -3.056 1.00 0.54 C ATOM 1443 N3 DA B 109 -7.479 10.069 -3.958 1.00 0.52 N ATOM 1444 C4 DA B 109 -7.085 10.437 -5.194 1.00 0.52 C ATOM 1445 H5' DA B 109 -10.001 7.833 -9.977 1.00 0.63 H ATOM 1446 H5'' DA B 109 -11.223 9.074 -10.313 1.00 0.63 H ATOM 1447 H4' DA B 109 -11.253 8.332 -7.951 1.00 0.56 H ATOM 1448 H3' DA B 109 -10.857 11.146 -8.777 1.00 0.48 H ATOM 1449 H2' DA B 109 -9.654 11.830 -6.975 1.00 0.49 H ATOM 1450 H2'' DA B 109 -10.838 11.063 -5.880 1.00 0.51 H ATOM 1451 H1' DA B 109 -9.453 9.290 -5.527 1.00 0.55 H ATOM 1452 H8 DA B 109 -7.312 10.874 -8.368 1.00 0.56 H ATOM 1453 H61 DA B 109 -3.128 11.864 -3.941 1.00 0.64 H ATOM 1454 H62 DA B 109 -3.475 12.005 -5.650 1.00 0.63 H ATOM 1455 H2 DA B 109 -6.765 10.045 -2.025 1.00 0.55 H ATOM 1456 P DA B 110 -13.149 11.755 -7.055 1.00 0.51 P ATOM 1457 OP1 DA B 110 -14.608 11.506 -7.059 1.00 0.57 O ATOM 1458 OP2 DA B 110 -12.599 12.928 -7.771 1.00 0.50 O ATOM 1459 O5' DA B 110 -12.654 11.822 -5.523 1.00 0.52 O ATOM 1460 C5' DA B 110 -13.204 10.937 -4.543 1.00 0.59 C ATOM 1461 C4' DA B 110 -12.754 11.310 -3.127 1.00 0.57 C ATOM 1462 O4' DA B 110 -11.313 11.415 -3.069 1.00 0.55 O ATOM 1463 C3' DA B 110 -13.354 12.645 -2.660 1.00 0.53 C ATOM 1464 O3' DA B 110 -14.158 12.451 -1.487 1.00 0.60 O ATOM 1465 C2' DA B 110 -12.167 13.540 -2.366 1.00 0.48 C ATOM 1466 C1' DA B 110 -10.917 12.684 -2.510 1.00 0.48 C ATOM 1467 N9 DA B 110 -9.922 13.354 -3.370 1.00 0.43 N ATOM 1468 C8 DA B 110 -10.053 13.806 -4.651 1.00 0.43 C ATOM 1469 N7 DA B 110 -8.993 14.377 -5.144 1.00 0.42 N ATOM 1470 C5 DA B 110 -8.076 14.296 -4.096 1.00 0.43 C ATOM 1471 C6 DA B 110 -6.748 14.719 -3.960 1.00 0.46 C ATOM 1472 N6 DA B 110 -6.077 15.343 -4.928 1.00 0.51 N ATOM 1473 N1 DA B 110 -6.140 14.478 -2.785 1.00 0.48 N ATOM 1474 C2 DA B 110 -6.795 13.859 -1.803 1.00 0.46 C ATOM 1475 N3 DA B 110 -8.048 13.420 -1.828 1.00 0.44 N ATOM 1476 C4 DA B 110 -8.634 13.674 -3.015 1.00 0.42 C ATOM 1477 H5' DA B 110 -12.880 9.919 -4.762 1.00 0.71 H ATOM 1478 H5'' DA B 110 -14.292 10.982 -4.594 1.00 0.60 H ATOM 1479 H4' DA B 110 -13.075 10.525 -2.441 1.00 0.63 H ATOM 1480 H3' DA B 110 -13.969 13.090 -3.449 1.00 0.52 H ATOM 1481 H2' DA B 110 -12.130 14.368 -3.077 1.00 0.47 H ATOM 1482 H2'' DA B 110 -12.236 13.930 -1.354 1.00 0.53 H ATOM 1483 H1' DA B 110 -10.477 12.516 -1.523 1.00 0.52 H ATOM 1484 H8 DA B 110 -10.978 13.698 -5.218 1.00 0.44 H ATOM 1485 H61 DA B 110 -5.119 15.627 -4.777 1.00 0.55 H ATOM 1486 H62 DA B 110 -6.526 15.531 -5.813 1.00 0.51 H ATOM 1487 H2 DA B 110 -6.243 13.696 -0.877 1.00 0.48 H ATOM 1488 P DT B 111 -14.754 13.705 -0.664 1.00 0.62 P ATOM 1489 OP1 DT B 111 -15.916 13.234 0.123 1.00 0.73 O ATOM 1490 OP2 DT B 111 -14.907 14.843 -1.597 1.00 0.61 O ATOM 1491 O5' DT B 111 -13.555 14.048 0.360 1.00 0.58 O ATOM 1492 C5' DT B 111 -12.882 12.995 1.059 1.00 0.61 C ATOM 1493 C4' DT B 111 -11.789 13.523 1.998 1.00 0.54 C ATOM 1494 O4' DT B 111 -10.566 13.767 1.264 1.00 0.48 O ATOM 1495 C3' DT B 111 -12.190 14.831 2.695 1.00 0.56 C ATOM 1496 O3' DT B 111 -12.341 14.626 4.103 1.00 0.61 O ATOM 1497 C2' DT B 111 -11.054 15.800 2.425 1.00 0.50 C ATOM 1498 C1' DT B 111 -9.980 15.021 1.670 1.00 0.44 C ATOM 1499 N1 DT B 111 -9.489 15.791 0.491 1.00 0.43 N ATOM 1500 C2 DT B 111 -8.147 16.148 0.452 1.00 0.42 C ATOM 1501 O2 DT B 111 -7.364 15.838 1.348 1.00 0.41 O ATOM 1502 N3 DT B 111 -7.739 16.871 -0.653 1.00 0.45 N ATOM 1503 C4 DT B 111 -8.538 17.263 -1.712 1.00 0.50 C ATOM 1504 O4 DT B 111 -8.066 17.901 -2.650 1.00 0.55 O ATOM 1505 C5 DT B 111 -9.918 16.852 -1.592 1.00 0.50 C ATOM 1506 C7 DT B 111 -10.908 17.242 -2.692 1.00 0.58 C ATOM 1507 C6 DT B 111 -10.343 16.144 -0.520 1.00 0.48 C ATOM 1508 H5' DT B 111 -12.428 12.322 0.332 1.00 0.66 H ATOM 1509 H5'' DT B 111 -13.615 12.439 1.645 1.00 0.68 H ATOM 1510 H4' DT B 111 -11.591 12.769 2.761 1.00 0.57 H ATOM 1511 H3' DT B 111 -13.124 15.222 2.280 1.00 0.61 H ATOM 1512 H2' DT B 111 -11.404 16.636 1.818 1.00 0.53 H ATOM 1513 H2'' DT B 111 -10.655 16.175 3.370 1.00 0.51 H ATOM 1514 H1' DT B 111 -9.147 14.807 2.350 1.00 0.44 H ATOM 1515 H3 DT B 111 -6.768 17.143 -0.688 1.00 0.47 H ATOM 1516 H71 DT B 111 -10.447 17.082 -3.667 1.00 1.17 H ATOM 1517 H72 DT B 111 -11.170 18.295 -2.586 1.00 1.17 H ATOM 1518 H73 DT B 111 -11.812 16.636 -2.616 1.00 1.19 H ATOM 1519 H6 DT B 111 -11.387 15.851 -0.456 1.00 0.51 H ATOM 1520 P DT B 112 -12.698 15.859 5.077 1.00 0.67 P ATOM 1521 OP1 DT B 112 -13.316 15.313 6.307 1.00 0.75 O ATOM 1522 OP2 DT B 112 -13.413 16.884 4.284 1.00 0.72 O ATOM 1523 O5' DT B 112 -11.245 16.439 5.457 1.00 0.59 O ATOM 1524 C5' DT B 112 -10.320 15.648 6.209 1.00 0.61 C ATOM 1525 C4' DT B 112 -9.062 16.442 6.575 1.00 0.55 C ATOM 1526 O4' DT B 112 -8.368 16.861 5.378 1.00 0.52 O ATOM 1527 C3' DT B 112 -9.388 17.693 7.403 1.00 0.60 C ATOM 1528 O3' DT B 112 -8.842 17.586 8.720 1.00 0.66 O ATOM 1529 C2' DT B 112 -8.759 18.853 6.658 1.00 0.59 C ATOM 1530 C1' DT B 112 -8.067 18.272 5.428 1.00 0.54 C ATOM 1531 N1 DT B 112 -8.540 18.950 4.193 1.00 0.59 N ATOM 1532 C2 DT B 112 -7.624 19.673 3.440 1.00 0.66 C ATOM 1533 O2 DT B 112 -6.442 19.766 3.763 1.00 0.68 O ATOM 1534 N3 DT B 112 -8.119 20.283 2.303 1.00 0.74 N ATOM 1535 C4 DT B 112 -9.427 20.239 1.857 1.00 0.78 C ATOM 1536 O4 DT B 112 -9.757 20.822 0.826 1.00 0.88 O ATOM 1537 C5 DT B 112 -10.311 19.465 2.702 1.00 0.72 C ATOM 1538 C7 DT B 112 -11.790 19.346 2.322 1.00 0.82 C ATOM 1539 C6 DT B 112 -9.848 18.858 3.820 1.00 0.63 C ATOM 1540 H5' DT B 112 -10.033 14.779 5.617 1.00 0.64 H ATOM 1541 H5'' DT B 112 -10.806 15.309 7.125 1.00 0.72 H ATOM 1542 H4' DT B 112 -8.399 15.799 7.157 1.00 0.55 H ATOM 1543 H3' DT B 112 -10.471 17.839 7.473 1.00 0.66 H ATOM 1544 H2' DT B 112 -9.525 19.568 6.349 1.00 0.63 H ATOM 1545 H2'' DT B 112 -8.031 19.351 7.303 1.00 0.63 H ATOM 1546 H1' DT B 112 -6.989 18.392 5.529 1.00 0.56 H ATOM 1547 H3 DT B 112 -7.464 20.812 1.746 1.00 0.81 H ATOM 1548 H71 DT B 112 -11.872 19.139 1.255 1.00 1.38 H ATOM 1549 H72 DT B 112 -12.298 20.282 2.549 1.00 1.31 H ATOM 1550 H73 DT B 112 -12.257 18.535 2.884 1.00 1.28 H ATOM 1551 H6 DT B 112 -10.530 18.281 4.440 1.00 0.63 H ATOM 1552 P DC B 113 -9.381 18.533 9.905 1.00 0.76 P ATOM 1553 OP1 DC B 113 -9.348 17.760 11.167 1.00 0.96 O ATOM 1554 OP2 DC B 113 -10.644 19.161 9.458 1.00 0.79 O ATOM 1555 O5' DC B 113 -8.250 19.676 9.984 1.00 0.81 O ATOM 1556 C5' DC B 113 -6.950 19.375 10.499 1.00 0.91 C ATOM 1557 C4' DC B 113 -5.952 20.500 10.205 1.00 1.00 C ATOM 1558 O4' DC B 113 -5.986 20.851 8.805 1.00 0.92 O ATOM 1559 C3' DC B 113 -6.244 21.764 11.024 1.00 1.14 C ATOM 1560 O3' DC B 113 -5.219 21.986 11.995 1.00 1.38 O ATOM 1561 C2' DC B 113 -6.290 22.899 10.021 1.00 1.16 C ATOM 1562 C1' DC B 113 -6.102 22.280 8.638 1.00 0.99 C ATOM 1563 N1 DC B 113 -7.253 22.605 7.762 1.00 0.89 N ATOM 1564 C2 DC B 113 -7.096 23.595 6.797 1.00 0.92 C ATOM 1565 O2 DC B 113 -6.018 24.175 6.681 1.00 1.01 O ATOM 1566 N3 DC B 113 -8.157 23.894 5.999 1.00 0.94 N ATOM 1567 C4 DC B 113 -9.324 23.252 6.138 1.00 0.96 C ATOM 1568 N4 DC B 113 -10.343 23.568 5.340 1.00 1.11 N ATOM 1569 C5 DC B 113 -9.489 22.233 7.129 1.00 0.91 C ATOM 1570 C6 DC B 113 -8.432 21.947 7.914 1.00 0.85 C ATOM 1571 H5' DC B 113 -6.592 18.454 10.040 1.00 0.98 H ATOM 1572 H5'' DC B 113 -7.019 19.233 11.577 1.00 1.03 H ATOM 1573 H4' DC B 113 -4.951 20.149 10.452 1.00 1.14 H ATOM 1574 H3' DC B 113 -7.210 21.679 11.533 1.00 1.14 H ATOM 1575 HO3' DC B 113 -5.460 21.494 12.783 1.00 1.63 H ATOM 1576 H2' DC B 113 -7.254 23.411 10.069 1.00 1.18 H ATOM 1577 H2'' DC B 113 -5.487 23.608 10.233 1.00 1.35 H ATOM 1578 H1' DC B 113 -5.180 22.653 8.192 1.00 1.11 H ATOM 1579 H41 DC B 113 -10.232 24.286 4.639 1.00 1.16 H ATOM 1580 H42 DC B 113 -11.228 23.090 5.438 1.00 1.19 H ATOM 1581 H5 DC B 113 -10.437 21.709 7.246 1.00 0.98 H ATOM 1582 H6 DC B 113 -8.519 21.180 8.680 1.00 0.85 H TER 1583 DC B 113 ATOM 1584 O5' DG C 114 -8.012 30.061 -2.218 1.00 2.07 O ATOM 1585 C5' DG C 114 -6.913 30.974 -2.157 1.00 2.03 C ATOM 1586 C4' DG C 114 -5.668 30.316 -1.555 1.00 1.74 C ATOM 1587 O4' DG C 114 -5.919 29.928 -0.186 1.00 1.68 O ATOM 1588 C3' DG C 114 -5.236 29.069 -2.338 1.00 1.52 C ATOM 1589 O3' DG C 114 -3.933 29.251 -2.898 1.00 1.50 O ATOM 1590 C2' DG C 114 -5.235 27.933 -1.336 1.00 1.32 C ATOM 1591 C1' DG C 114 -5.667 28.520 0.004 1.00 1.41 C ATOM 1592 N9 DG C 114 -6.880 27.842 0.504 1.00 1.37 N ATOM 1593 C8 DG C 114 -8.140 27.836 -0.023 1.00 1.49 C ATOM 1594 N7 DG C 114 -9.014 27.142 0.643 1.00 1.49 N ATOM 1595 C5 DG C 114 -8.274 26.639 1.711 1.00 1.32 C ATOM 1596 C6 DG C 114 -8.681 25.804 2.787 1.00 1.26 C ATOM 1597 O6 DG C 114 -9.796 25.338 3.011 1.00 1.34 O ATOM 1598 N1 DG C 114 -7.626 25.530 3.647 1.00 1.14 N ATOM 1599 C2 DG C 114 -6.337 25.999 3.494 1.00 1.14 C ATOM 1600 N2 DG C 114 -5.459 25.626 4.426 1.00 1.15 N ATOM 1601 N3 DG C 114 -5.950 26.784 2.484 1.00 1.21 N ATOM 1602 C4 DG C 114 -6.966 27.062 1.634 1.00 1.27 C ATOM 1603 H5' DG C 114 -7.196 31.829 -1.543 1.00 2.19 H ATOM 1604 H5'' DG C 114 -6.681 31.320 -3.164 1.00 2.15 H ATOM 1605 H4' DG C 114 -4.851 31.038 -1.569 1.00 1.82 H ATOM 1606 H3' DG C 114 -5.946 28.854 -3.144 1.00 1.63 H ATOM 1607 H2' DG C 114 -5.936 27.154 -1.642 1.00 1.31 H ATOM 1608 H2'' DG C 114 -4.230 27.512 -1.260 1.00 1.26 H ATOM 1609 H1' DG C 114 -4.865 28.399 0.735 1.00 1.40 H ATOM 1610 H8 DG C 114 -8.394 28.373 -0.937 1.00 1.61 H ATOM 1611 H1 DG C 114 -7.840 24.940 4.438 1.00 1.11 H ATOM 1612 H21 DG C 114 -5.753 25.033 5.188 1.00 1.12 H ATOM 1613 H22 DG C 114 -4.500 25.937 4.369 1.00 1.22 H ATOM 1614 HO5' DG C 114 -8.537 30.298 -2.986 1.00 2.45 H ATOM 1615 P DA C 115 -3.305 28.145 -3.884 1.00 1.41 P ATOM 1616 OP1 DA C 115 -2.296 28.808 -4.741 1.00 1.52 O ATOM 1617 OP2 DA C 115 -4.418 27.391 -4.503 1.00 1.51 O ATOM 1618 O5' DA C 115 -2.536 27.163 -2.867 1.00 1.30 O ATOM 1619 C5' DA C 115 -1.579 27.683 -1.939 1.00 1.33 C ATOM 1620 C4' DA C 115 -0.987 26.574 -1.063 1.00 1.22 C ATOM 1621 O4' DA C 115 -2.020 25.981 -0.241 1.00 1.15 O ATOM 1622 C3' DA C 115 -0.340 25.462 -1.899 1.00 1.17 C ATOM 1623 O3' DA C 115 1.042 25.310 -1.549 1.00 1.22 O ATOM 1624 C2' DA C 115 -1.119 24.204 -1.577 1.00 1.14 C ATOM 1625 C1' DA C 115 -2.128 24.565 -0.496 1.00 1.07 C ATOM 1626 N9 DA C 115 -3.501 24.213 -0.909 1.00 1.02 N ATOM 1627 C8 DA C 115 -4.191 24.584 -2.028 1.00 1.08 C ATOM 1628 N7 DA C 115 -5.403 24.118 -2.108 1.00 1.05 N ATOM 1629 C5 DA C 115 -5.531 23.370 -0.937 1.00 0.95 C ATOM 1630 C6 DA C 115 -6.580 22.610 -0.403 1.00 0.90 C ATOM 1631 N6 DA C 115 -7.761 22.471 -1.005 1.00 0.95 N ATOM 1632 N1 DA C 115 -6.365 22.002 0.776 1.00 0.82 N ATOM 1633 C2 DA C 115 -5.191 22.131 1.395 1.00 0.81 C ATOM 1634 N3 DA C 115 -4.137 22.824 0.979 1.00 0.88 N ATOM 1635 C4 DA C 115 -4.379 23.423 -0.204 1.00 0.94 C ATOM 1636 H5' DA C 115 -2.067 28.419 -1.300 1.00 1.39 H ATOM 1637 H5'' DA C 115 -0.775 28.168 -2.491 1.00 1.43 H ATOM 1638 H4' DA C 115 -0.229 27.010 -0.413 1.00 1.27 H ATOM 1639 H3' DA C 115 -0.417 25.685 -2.969 1.00 1.18 H ATOM 1640 H2' DA C 115 -1.642 23.839 -2.464 1.00 1.17 H ATOM 1641 H2'' DA C 115 -0.440 23.440 -1.208 1.00 1.20 H ATOM 1642 H1' DA C 115 -1.885 24.018 0.418 1.00 1.06 H ATOM 1643 H8 DA C 115 -3.758 25.224 -2.797 1.00 1.16 H ATOM 1644 H61 DA C 115 -8.484 21.910 -0.575 1.00 0.93 H ATOM 1645 H62 DA C 115 -7.934 22.925 -1.890 1.00 1.03 H ATOM 1646 H2 DA C 115 -5.085 21.611 2.347 1.00 0.77 H ATOM 1647 P DA C 116 1.928 24.112 -2.168 1.00 1.24 P ATOM 1648 OP1 DA C 116 3.356 24.426 -1.939 1.00 1.44 O ATOM 1649 OP2 DA C 116 1.443 23.838 -3.539 1.00 1.30 O ATOM 1650 O5' DA C 116 1.528 22.861 -1.230 1.00 1.04 O ATOM 1651 C5' DA C 116 1.729 22.922 0.186 1.00 1.07 C ATOM 1652 C4' DA C 116 1.071 21.741 0.912 1.00 0.83 C ATOM 1653 O4' DA C 116 -0.365 21.742 0.715 1.00 0.77 O ATOM 1654 C3' DA C 116 1.612 20.385 0.432 1.00 0.75 C ATOM 1655 O3' DA C 116 2.279 19.710 1.511 1.00 0.74 O ATOM 1656 C2' DA C 116 0.391 19.613 -0.034 1.00 0.62 C ATOM 1657 C1' DA C 116 -0.820 20.403 0.430 1.00 0.62 C ATOM 1658 N9 DA C 116 -1.891 20.394 -0.587 1.00 0.64 N ATOM 1659 C8 DA C 116 -1.910 20.959 -1.825 1.00 0.71 C ATOM 1660 N7 DA C 116 -3.004 20.773 -2.502 1.00 0.74 N ATOM 1661 C5 DA C 116 -3.786 20.016 -1.633 1.00 0.67 C ATOM 1662 C6 DA C 116 -5.074 19.478 -1.740 1.00 0.67 C ATOM 1663 N6 DA C 116 -5.839 19.629 -2.821 1.00 0.75 N ATOM 1664 N1 DA C 116 -5.543 18.781 -0.690 1.00 0.61 N ATOM 1665 C2 DA C 116 -4.791 18.620 0.399 1.00 0.56 C ATOM 1666 N3 DA C 116 -3.562 19.085 0.602 1.00 0.56 N ATOM 1667 C4 DA C 116 -3.118 19.780 -0.466 1.00 0.61 C ATOM 1668 H5' DA C 116 1.302 23.851 0.564 1.00 1.17 H ATOM 1669 H5'' DA C 116 2.799 22.914 0.393 1.00 1.25 H ATOM 1670 H4' DA C 116 1.274 21.836 1.978 1.00 0.82 H ATOM 1671 H3' DA C 116 2.311 20.517 -0.401 1.00 0.89 H ATOM 1672 H2' DA C 116 0.383 19.532 -1.122 1.00 0.71 H ATOM 1673 H2'' DA C 116 0.381 18.623 0.408 1.00 0.57 H ATOM 1674 H1' DA C 116 -1.206 19.959 1.347 1.00 0.57 H ATOM 1675 H8 DA C 116 -1.071 21.522 -2.217 1.00 0.75 H ATOM 1676 H61 DA C 116 -6.763 19.221 -2.846 1.00 0.75 H ATOM 1677 H62 DA C 116 -5.496 20.151 -3.614 1.00 0.81 H ATOM 1678 H2 DA C 116 -5.232 18.044 1.213 1.00 0.53 H ATOM 1679 P DT C 117 2.761 18.176 1.379 1.00 1.08 P ATOM 1680 OP1 DT C 117 3.756 17.909 2.442 1.00 1.74 O ATOM 1681 OP2 DT C 117 3.106 17.917 -0.037 1.00 1.77 O ATOM 1682 O5' DT C 117 1.414 17.358 1.730 1.00 0.82 O ATOM 1683 C5' DT C 117 0.631 17.708 2.877 1.00 0.80 C ATOM 1684 C4' DT C 117 -0.517 16.716 3.118 1.00 0.64 C ATOM 1685 O4' DT C 117 -1.665 17.058 2.306 1.00 0.56 O ATOM 1686 C3' DT C 117 -0.120 15.272 2.785 1.00 0.58 C ATOM 1687 O3' DT C 117 -0.094 14.466 3.963 1.00 0.63 O ATOM 1688 C2' DT C 117 -1.185 14.764 1.833 1.00 0.52 C ATOM 1689 C1' DT C 117 -2.228 15.870 1.710 1.00 0.51 C ATOM 1690 N1 DT C 117 -2.590 16.101 0.285 1.00 0.49 N ATOM 1691 C2 DT C 117 -3.895 15.849 -0.119 1.00 0.55 C ATOM 1692 O2 DT C 117 -4.755 15.448 0.661 1.00 0.62 O ATOM 1693 N3 DT C 117 -4.171 16.076 -1.456 1.00 0.57 N ATOM 1694 C4 DT C 117 -3.276 16.525 -2.408 1.00 0.54 C ATOM 1695 O4 DT C 117 -3.631 16.692 -3.573 1.00 0.59 O ATOM 1696 C5 DT C 117 -1.946 16.760 -1.896 1.00 0.48 C ATOM 1697 C7 DT C 117 -0.857 17.261 -2.841 1.00 0.50 C ATOM 1698 C6 DT C 117 -1.652 16.546 -0.597 1.00 0.46 C ATOM 1699 H5' DT C 117 0.213 18.704 2.733 1.00 0.90 H ATOM 1700 H5'' DT C 117 1.279 17.721 3.754 1.00 0.96 H ATOM 1701 H4' DT C 117 -0.807 16.764 4.168 1.00 0.75 H ATOM 1702 H3' DT C 117 0.862 15.240 2.303 1.00 0.65 H ATOM 1703 H2' DT C 117 -0.751 14.554 0.855 1.00 0.57 H ATOM 1704 H2'' DT C 117 -1.639 13.857 2.236 1.00 0.59 H ATOM 1705 H1' DT C 117 -3.116 15.589 2.276 1.00 0.58 H ATOM 1706 H3 DT C 117 -5.114 15.895 -1.765 1.00 0.65 H ATOM 1707 H71 DT C 117 -1.104 16.975 -3.864 1.00 1.06 H ATOM 1708 H72 DT C 117 0.100 16.821 -2.562 1.00 1.12 H ATOM 1709 H73 DT C 117 -0.791 18.347 -2.775 1.00 1.12 H ATOM 1710 H6 DT C 117 -0.644 16.717 -0.241 1.00 0.47 H ATOM 1711 P DT C 118 0.282 12.905 3.865 1.00 0.67 P ATOM 1712 OP1 DT C 118 0.920 12.506 5.137 1.00 0.79 O ATOM 1713 OP2 DT C 118 0.988 12.679 2.583 1.00 0.71 O ATOM 1714 O5' DT C 118 -1.162 12.198 3.776 1.00 0.64 O ATOM 1715 C5' DT C 118 -2.017 12.142 4.920 1.00 0.70 C ATOM 1716 C4' DT C 118 -3.325 11.406 4.610 1.00 0.66 C ATOM 1717 O4' DT C 118 -3.960 11.982 3.446 1.00 0.64 O ATOM 1718 C3' DT C 118 -3.101 9.912 4.345 1.00 0.63 C ATOM 1719 O3' DT C 118 -3.743 9.118 5.347 1.00 0.66 O ATOM 1720 C2' DT C 118 -3.704 9.641 2.982 1.00 0.61 C ATOM 1721 C1' DT C 118 -4.262 10.965 2.468 1.00 0.61 C ATOM 1722 N1 DT C 118 -3.651 11.312 1.156 1.00 0.58 N ATOM 1723 C2 DT C 118 -4.473 11.361 0.038 1.00 0.59 C ATOM 1724 O2 DT C 118 -5.677 11.128 0.103 1.00 0.62 O ATOM 1725 N3 DT C 118 -3.858 11.688 -1.156 1.00 0.59 N ATOM 1726 C4 DT C 118 -2.514 11.965 -1.333 1.00 0.58 C ATOM 1727 O4 DT C 118 -2.074 12.244 -2.446 1.00 0.60 O ATOM 1728 C5 DT C 118 -1.733 11.891 -0.120 1.00 0.57 C ATOM 1729 C7 DT C 118 -0.230 12.176 -0.185 1.00 0.58 C ATOM 1730 C6 DT C 118 -2.310 11.574 1.062 1.00 0.57 C ATOM 1731 H5' DT C 118 -2.248 13.157 5.242 1.00 0.83 H ATOM 1732 H5'' DT C 118 -1.500 11.622 5.726 1.00 0.76 H ATOM 1733 H4' DT C 118 -3.996 11.513 5.462 1.00 0.69 H ATOM 1734 H3' DT C 118 -2.031 9.678 4.332 1.00 0.64 H ATOM 1735 H2' DT C 118 -2.940 9.274 2.295 1.00 0.60 H ATOM 1736 H2'' DT C 118 -4.502 8.901 3.073 1.00 0.64 H ATOM 1737 H1' DT C 118 -5.350 10.887 2.369 1.00 0.64 H ATOM 1738 H3 DT C 118 -4.445 11.728 -1.976 1.00 0.62 H ATOM 1739 H71 DT C 118 0.286 11.305 -0.589 1.00 1.18 H ATOM 1740 H72 DT C 118 0.154 12.392 0.814 1.00 1.11 H ATOM 1741 H73 DT C 118 -0.053 13.035 -0.833 1.00 1.20 H ATOM 1742 H6 DT C 118 -1.694 11.525 1.960 1.00 0.58 H ATOM 1743 P DT C 119 -3.731 7.511 5.247 1.00 0.64 P ATOM 1744 OP1 DT C 119 -4.246 6.964 6.522 1.00 0.70 O ATOM 1745 OP2 DT C 119 -2.405 7.088 4.745 1.00 0.64 O ATOM 1746 O5' DT C 119 -4.822 7.221 4.098 1.00 0.60 O ATOM 1747 C5' DT C 119 -6.208 7.108 4.428 1.00 0.66 C ATOM 1748 C4' DT C 119 -7.056 6.745 3.204 1.00 0.63 C ATOM 1749 O4' DT C 119 -6.727 7.607 2.091 1.00 0.59 O ATOM 1750 C3' DT C 119 -6.845 5.291 2.760 1.00 0.59 C ATOM 1751 O3' DT C 119 -8.040 4.525 2.932 1.00 0.64 O ATOM 1752 C2' DT C 119 -6.472 5.361 1.295 1.00 0.53 C ATOM 1753 C1' DT C 119 -6.523 6.832 0.891 1.00 0.53 C ATOM 1754 N1 DT C 119 -5.260 7.236 0.210 1.00 0.48 N ATOM 1755 C2 DT C 119 -5.335 7.678 -1.104 1.00 0.47 C ATOM 1756 O2 DT C 119 -6.404 7.754 -1.707 1.00 0.49 O ATOM 1757 N3 DT C 119 -4.138 8.030 -1.699 1.00 0.45 N ATOM 1758 C4 DT C 119 -2.888 7.980 -1.109 1.00 0.44 C ATOM 1759 O4 DT C 119 -1.886 8.316 -1.739 1.00 0.45 O ATOM 1760 C5 DT C 119 -2.900 7.509 0.258 1.00 0.46 C ATOM 1761 C7 DT C 119 -1.574 7.395 1.016 1.00 0.48 C ATOM 1762 C6 DT C 119 -4.058 7.160 0.864 1.00 0.48 C ATOM 1763 H5' DT C 119 -6.556 8.059 4.832 1.00 0.72 H ATOM 1764 H5'' DT C 119 -6.331 6.334 5.186 1.00 0.73 H ATOM 1765 H4' DT C 119 -8.108 6.885 3.455 1.00 0.67 H ATOM 1766 H3' DT C 119 -6.034 4.826 3.330 1.00 0.59 H ATOM 1767 H2' DT C 119 -5.467 4.969 1.141 1.00 0.51 H ATOM 1768 H2'' DT C 119 -7.186 4.780 0.706 1.00 0.54 H ATOM 1769 H1' DT C 119 -7.378 6.995 0.225 1.00 0.55 H ATOM 1770 H3 DT C 119 -4.180 8.353 -2.654 1.00 0.46 H ATOM 1771 H71 DT C 119 -0.985 8.297 0.852 1.00 1.14 H ATOM 1772 H72 DT C 119 -1.021 6.531 0.648 1.00 1.05 H ATOM 1773 H73 DT C 119 -1.761 7.275 2.085 1.00 1.07 H ATOM 1774 H6 DT C 119 -4.037 6.809 1.896 1.00 0.51 H ATOM 1775 P DA C 120 -8.068 2.962 2.544 1.00 0.63 P ATOM 1776 OP1 DA C 120 -9.355 2.394 3.005 1.00 0.68 O ATOM 1777 OP2 DA C 120 -6.794 2.353 2.985 1.00 0.66 O ATOM 1778 O5' DA C 120 -8.081 2.994 0.933 1.00 0.56 O ATOM 1779 C5' DA C 120 -9.221 2.523 0.209 1.00 0.54 C ATOM 1780 C4' DA C 120 -8.846 2.025 -1.192 1.00 0.48 C ATOM 1781 O4' DA C 120 -7.968 2.969 -1.847 1.00 0.47 O ATOM 1782 C3' DA C 120 -8.143 0.661 -1.156 1.00 0.46 C ATOM 1783 O3' DA C 120 -8.948 -0.338 -1.788 1.00 0.47 O ATOM 1784 C2' DA C 120 -6.840 0.851 -1.909 1.00 0.44 C ATOM 1785 C1' DA C 120 -6.812 2.297 -2.392 1.00 0.42 C ATOM 1786 N9 DA C 120 -5.569 2.965 -1.962 1.00 0.41 N ATOM 1787 C8 DA C 120 -5.076 3.132 -0.702 1.00 0.44 C ATOM 1788 N7 DA C 120 -3.944 3.767 -0.632 1.00 0.44 N ATOM 1789 C5 DA C 120 -3.658 4.049 -1.966 1.00 0.41 C ATOM 1790 C6 DA C 120 -2.592 4.709 -2.588 1.00 0.41 C ATOM 1791 N6 DA C 120 -1.565 5.234 -1.918 1.00 0.45 N ATOM 1792 N1 DA C 120 -2.624 4.809 -3.928 1.00 0.40 N ATOM 1793 C2 DA C 120 -3.642 4.292 -4.617 1.00 0.39 C ATOM 1794 N3 DA C 120 -4.699 3.651 -4.127 1.00 0.38 N ATOM 1795 C4 DA C 120 -4.641 3.564 -2.783 1.00 0.39 C ATOM 1796 H5' DA C 120 -9.942 3.335 0.115 1.00 0.60 H ATOM 1797 H5'' DA C 120 -9.679 1.704 0.764 1.00 0.55 H ATOM 1798 H4' DA C 120 -9.757 1.931 -1.783 1.00 0.50 H ATOM 1799 H3' DA C 120 -7.936 0.359 -0.124 1.00 0.50 H ATOM 1800 H2' DA C 120 -5.989 0.665 -1.249 1.00 0.46 H ATOM 1801 H2'' DA C 120 -6.801 0.166 -2.758 1.00 0.44 H ATOM 1802 H1' DA C 120 -6.871 2.321 -3.483 1.00 0.42 H ATOM 1803 H8 DA C 120 -5.593 2.759 0.182 1.00 0.47 H ATOM 1804 H61 DA C 120 -0.821 5.700 -2.418 1.00 0.46 H ATOM 1805 H62 DA C 120 -1.531 5.164 -0.911 1.00 0.47 H ATOM 1806 H2 DA C 120 -3.603 4.408 -5.699 1.00 0.39 H ATOM 1807 P DC C 121 -8.399 -1.841 -1.965 1.00 0.48 P ATOM 1808 OP1 DC C 121 -9.555 -2.729 -2.224 1.00 0.54 O ATOM 1809 OP2 DC C 121 -7.480 -2.134 -0.842 1.00 0.52 O ATOM 1810 O5' DC C 121 -7.529 -1.739 -3.316 1.00 0.43 O ATOM 1811 C5' DC C 121 -8.140 -1.326 -4.541 1.00 0.43 C ATOM 1812 C4' DC C 121 -7.270 -1.680 -5.753 1.00 0.41 C ATOM 1813 O4' DC C 121 -6.256 -0.670 -5.959 1.00 0.41 O ATOM 1814 C3' DC C 121 -6.574 -3.038 -5.590 1.00 0.41 C ATOM 1815 O3' DC C 121 -7.057 -3.967 -6.573 1.00 0.44 O ATOM 1816 C2' DC C 121 -5.093 -2.760 -5.774 1.00 0.38 C ATOM 1817 C1' DC C 121 -4.944 -1.267 -6.046 1.00 0.37 C ATOM 1818 N1 DC C 121 -4.018 -0.623 -5.071 1.00 0.36 N ATOM 1819 C2 DC C 121 -2.940 0.106 -5.570 1.00 0.36 C ATOM 1820 O2 DC C 121 -2.757 0.176 -6.783 1.00 0.36 O ATOM 1821 N3 DC C 121 -2.112 0.727 -4.688 1.00 0.38 N ATOM 1822 C4 DC C 121 -2.324 0.644 -3.370 1.00 0.39 C ATOM 1823 N4 DC C 121 -1.495 1.268 -2.533 1.00 0.43 N ATOM 1824 C5 DC C 121 -3.426 -0.102 -2.847 1.00 0.38 C ATOM 1825 C6 DC C 121 -4.241 -0.718 -3.726 1.00 0.38 C ATOM 1826 H5' DC C 121 -8.292 -0.247 -4.517 1.00 0.46 H ATOM 1827 H5'' DC C 121 -9.107 -1.819 -4.639 1.00 0.45 H ATOM 1828 H4' DC C 121 -7.906 -1.719 -6.639 1.00 0.44 H ATOM 1829 H3' DC C 121 -6.754 -3.447 -4.591 1.00 0.43 H ATOM 1830 H2' DC C 121 -4.537 -3.037 -4.876 1.00 0.40 H ATOM 1831 H2'' DC C 121 -4.718 -3.323 -6.620 1.00 0.38 H ATOM 1832 H1' DC C 121 -4.563 -1.131 -7.066 1.00 0.37 H ATOM 1833 H41 DC C 121 -0.715 1.797 -2.897 1.00 0.46 H ATOM 1834 H42 DC C 121 -1.646 1.213 -1.536 1.00 0.44 H ATOM 1835 H5 DC C 121 -3.606 -0.164 -1.775 1.00 0.41 H ATOM 1836 H6 DC C 121 -5.077 -1.313 -3.360 1.00 0.41 H ATOM 1837 P DT C 122 -6.313 -5.375 -6.836 1.00 0.46 P ATOM 1838 OP1 DT C 122 -7.308 -6.334 -7.366 1.00 0.52 O ATOM 1839 OP2 DT C 122 -5.525 -5.716 -5.630 1.00 0.46 O ATOM 1840 O5' DT C 122 -5.286 -5.001 -8.022 1.00 0.44 O ATOM 1841 C5' DT C 122 -5.640 -4.009 -8.992 1.00 0.51 C ATOM 1842 C4' DT C 122 -4.417 -3.458 -9.735 1.00 0.43 C ATOM 1843 O4' DT C 122 -3.656 -2.573 -8.880 1.00 0.43 O ATOM 1844 C3' DT C 122 -3.475 -4.569 -10.221 1.00 0.42 C ATOM 1845 O3' DT C 122 -3.464 -4.624 -11.651 1.00 0.46 O ATOM 1846 C2' DT C 122 -2.100 -4.195 -9.697 1.00 0.39 C ATOM 1847 C1' DT C 122 -2.244 -2.833 -9.022 1.00 0.40 C ATOM 1848 N1 DT C 122 -1.561 -2.805 -7.697 1.00 0.40 N ATOM 1849 C2 DT C 122 -0.533 -1.890 -7.499 1.00 0.45 C ATOM 1850 O2 DT C 122 -0.163 -1.122 -8.385 1.00 0.49 O ATOM 1851 N3 DT C 122 0.052 -1.894 -6.246 1.00 0.47 N ATOM 1852 C4 DT C 122 -0.292 -2.719 -5.188 1.00 0.47 C ATOM 1853 O4 DT C 122 0.294 -2.637 -4.112 1.00 0.52 O ATOM 1854 C5 DT C 122 -1.369 -3.635 -5.489 1.00 0.44 C ATOM 1855 C7 DT C 122 -1.862 -4.602 -4.415 1.00 0.49 C ATOM 1856 C6 DT C 122 -1.951 -3.650 -6.701 1.00 0.40 C ATOM 1857 H5' DT C 122 -6.145 -3.186 -8.486 1.00 0.59 H ATOM 1858 H5'' DT C 122 -6.324 -4.451 -9.716 1.00 0.67 H ATOM 1859 H4' DT C 122 -4.762 -2.893 -10.600 1.00 0.44 H ATOM 1860 H3' DT C 122 -3.780 -5.540 -9.820 1.00 0.46 H ATOM 1861 H2' DT C 122 -1.755 -4.937 -8.975 1.00 0.38 H ATOM 1862 H2'' DT C 122 -1.393 -4.134 -10.527 1.00 0.43 H ATOM 1863 H1' DT C 122 -1.819 -2.068 -9.670 1.00 0.45 H ATOM 1864 H3 DT C 122 0.803 -1.236 -6.088 1.00 0.52 H ATOM 1865 H71 DT C 122 -2.697 -4.150 -3.877 1.00 1.16 H ATOM 1866 H72 DT C 122 -1.050 -4.816 -3.723 1.00 1.04 H ATOM 1867 H73 DT C 122 -2.193 -5.531 -4.882 1.00 1.14 H ATOM 1868 H6 DT C 122 -2.741 -4.360 -6.895 1.00 0.40 H ATOM 1869 P DA C 123 -2.516 -5.670 -12.424 1.00 0.53 P ATOM 1870 OP1 DA C 123 -2.863 -5.635 -13.862 1.00 0.62 O ATOM 1871 OP2 DA C 123 -2.545 -6.954 -11.688 1.00 0.59 O ATOM 1872 O5' DA C 123 -1.056 -5.017 -12.242 1.00 0.52 O ATOM 1873 C5' DA C 123 -0.499 -4.185 -13.263 1.00 0.56 C ATOM 1874 C4' DA C 123 1.032 -4.227 -13.247 1.00 0.51 C ATOM 1875 O4' DA C 123 1.537 -3.637 -12.027 1.00 0.46 O ATOM 1876 C3' DA C 123 1.569 -5.662 -13.347 1.00 0.49 C ATOM 1877 O3' DA C 123 2.348 -5.835 -14.536 1.00 0.53 O ATOM 1878 C2' DA C 123 2.426 -5.863 -12.115 1.00 0.40 C ATOM 1879 C1' DA C 123 2.390 -4.564 -11.323 1.00 0.39 C ATOM 1880 N9 DA C 123 1.895 -4.792 -9.949 1.00 0.36 N ATOM 1881 C8 DA C 123 0.784 -5.466 -9.528 1.00 0.37 C ATOM 1882 N7 DA C 123 0.617 -5.502 -8.239 1.00 0.35 N ATOM 1883 C5 DA C 123 1.714 -4.787 -7.759 1.00 0.32 C ATOM 1884 C6 DA C 123 2.138 -4.453 -6.467 1.00 0.31 C ATOM 1885 N6 DA C 123 1.483 -4.820 -5.366 1.00 0.31 N ATOM 1886 N1 DA C 123 3.270 -3.736 -6.353 1.00 0.32 N ATOM 1887 C2 DA C 123 3.945 -3.369 -7.443 1.00 0.33 C ATOM 1888 N3 DA C 123 3.633 -3.633 -8.707 1.00 0.33 N ATOM 1889 C4 DA C 123 2.495 -4.352 -8.792 1.00 0.33 C ATOM 1890 H5' DA C 123 -0.828 -3.158 -13.105 1.00 0.66 H ATOM 1891 H5'' DA C 123 -0.855 -4.527 -14.234 1.00 0.63 H ATOM 1892 H4' DA C 123 1.406 -3.654 -14.095 1.00 0.54 H ATOM 1893 H3' DA C 123 0.746 -6.384 -13.349 1.00 0.53 H ATOM 1894 H2' DA C 123 2.034 -6.681 -11.508 1.00 0.39 H ATOM 1895 H2'' DA C 123 3.449 -6.083 -12.417 1.00 0.39 H ATOM 1896 H1' DA C 123 3.399 -4.151 -11.268 1.00 0.38 H ATOM 1897 H8 DA C 123 0.089 -5.939 -10.221 1.00 0.41 H ATOM 1898 H61 DA C 123 1.833 -4.552 -4.457 1.00 0.32 H ATOM 1899 H62 DA C 123 0.637 -5.368 -5.440 1.00 0.33 H ATOM 1900 H2 DA C 123 4.853 -2.788 -7.278 1.00 0.35 H ATOM 1901 P DC C 124 3.160 -7.204 -14.796 1.00 0.53 P ATOM 1902 OP1 DC C 124 3.745 -7.146 -16.154 1.00 0.60 O ATOM 1903 OP2 DC C 124 2.288 -8.338 -14.415 1.00 0.56 O ATOM 1904 O5' DC C 124 4.363 -7.109 -13.722 1.00 0.44 O ATOM 1905 C5' DC C 124 5.538 -6.347 -14.020 1.00 0.45 C ATOM 1906 C4' DC C 124 6.553 -6.366 -12.868 1.00 0.37 C ATOM 1907 O4' DC C 124 5.952 -5.868 -11.649 1.00 0.34 O ATOM 1908 C3' DC C 124 7.091 -7.778 -12.584 1.00 0.35 C ATOM 1909 O3' DC C 124 8.484 -7.865 -12.901 1.00 0.37 O ATOM 1910 C2' DC C 124 6.879 -8.001 -11.098 1.00 0.32 C ATOM 1911 C1' DC C 124 6.350 -6.687 -10.530 1.00 0.29 C ATOM 1912 N1 DC C 124 5.210 -6.923 -9.600 1.00 0.27 N ATOM 1913 C2 DC C 124 5.342 -6.524 -8.272 1.00 0.26 C ATOM 1914 O2 DC C 124 6.376 -5.980 -7.892 1.00 0.29 O ATOM 1915 N3 DC C 124 4.303 -6.754 -7.422 1.00 0.25 N ATOM 1916 C4 DC C 124 3.181 -7.345 -7.852 1.00 0.26 C ATOM 1917 N4 DC C 124 2.183 -7.555 -6.995 1.00 0.28 N ATOM 1918 C5 DC C 124 3.043 -7.753 -9.215 1.00 0.30 C ATOM 1919 C6 DC C 124 4.077 -7.521 -10.045 1.00 0.30 C ATOM 1920 H5' DC C 124 5.249 -5.315 -14.219 1.00 0.48 H ATOM 1921 H5'' DC C 124 6.009 -6.760 -14.912 1.00 0.51 H ATOM 1922 H4' DC C 124 7.391 -5.721 -13.132 1.00 0.38 H ATOM 1923 H3' DC C 124 6.539 -8.527 -13.159 1.00 0.40 H ATOM 1924 H2' DC C 124 6.156 -8.801 -10.936 1.00 0.35 H ATOM 1925 H2'' DC C 124 7.825 -8.263 -10.624 1.00 0.33 H ATOM 1926 H1' DC C 124 7.155 -6.177 -10.002 1.00 0.30 H ATOM 1927 H41 DC C 124 2.275 -7.269 -6.031 1.00 0.27 H ATOM 1928 H42 DC C 124 1.333 -8.000 -7.311 1.00 0.31 H ATOM 1929 H5 DC C 124 2.132 -8.236 -9.570 1.00 0.34 H ATOM 1930 H6 DC C 124 4.015 -7.824 -11.083 1.00 0.33 H ATOM 1931 P DT C 125 9.298 -9.232 -12.643 1.00 0.40 P ATOM 1932 OP1 DT C 125 10.572 -9.162 -13.393 1.00 0.46 O ATOM 1933 OP2 DT C 125 8.375 -10.369 -12.860 1.00 0.42 O ATOM 1934 O5' DT C 125 9.634 -9.149 -11.069 1.00 0.39 O ATOM 1935 C5' DT C 125 10.456 -8.095 -10.561 1.00 0.43 C ATOM 1936 C4' DT C 125 10.683 -8.222 -9.051 1.00 0.41 C ATOM 1937 O4' DT C 125 9.458 -7.946 -8.333 1.00 0.37 O ATOM 1938 C3' DT C 125 11.162 -9.624 -8.648 1.00 0.47 C ATOM 1939 O3' DT C 125 12.500 -9.580 -8.148 1.00 0.55 O ATOM 1940 C2' DT C 125 10.213 -10.079 -7.557 1.00 0.45 C ATOM 1941 C1' DT C 125 9.277 -8.905 -7.272 1.00 0.39 C ATOM 1942 N1 DT C 125 7.855 -9.349 -7.181 1.00 0.35 N ATOM 1943 C2 DT C 125 7.167 -9.114 -5.997 1.00 0.38 C ATOM 1944 O2 DT C 125 7.691 -8.549 -5.040 1.00 0.43 O ATOM 1945 N3 DT C 125 5.857 -9.552 -5.955 1.00 0.38 N ATOM 1946 C4 DT C 125 5.179 -10.198 -6.971 1.00 0.36 C ATOM 1947 O4 DT C 125 4.013 -10.557 -6.813 1.00 0.39 O ATOM 1948 C5 DT C 125 5.967 -10.400 -8.168 1.00 0.34 C ATOM 1949 C7 DT C 125 5.330 -11.114 -9.365 1.00 0.37 C ATOM 1950 C6 DT C 125 7.254 -9.977 -8.234 1.00 0.34 C ATOM 1951 H5' DT C 125 9.975 -7.139 -10.768 1.00 0.47 H ATOM 1952 H5'' DT C 125 11.421 -8.123 -11.068 1.00 0.56 H ATOM 1953 H4' DT C 125 11.436 -7.495 -8.749 1.00 0.44 H ATOM 1954 H3' DT C 125 11.114 -10.311 -9.499 1.00 0.50 H ATOM 1955 H2' DT C 125 9.642 -10.945 -7.890 1.00 0.46 H ATOM 1956 H2'' DT C 125 10.780 -10.338 -6.661 1.00 0.52 H ATOM 1957 H1' DT C 125 9.575 -8.436 -6.335 1.00 0.42 H ATOM 1958 H3 DT C 125 5.345 -9.380 -5.103 1.00 0.42 H ATOM 1959 H71 DT C 125 5.974 -11.029 -10.242 1.00 1.13 H ATOM 1960 H72 DT C 125 4.364 -10.659 -9.583 1.00 1.05 H ATOM 1961 H73 DT C 125 5.187 -12.167 -9.124 1.00 1.05 H ATOM 1962 H6 DT C 125 7.827 -10.138 -9.143 1.00 0.35 H ATOM 1963 P DC C 126 13.271 -10.940 -7.759 1.00 0.64 P ATOM 1964 OP1 DC C 126 14.626 -10.584 -7.284 1.00 0.75 O ATOM 1965 OP2 DC C 126 13.109 -11.899 -8.875 1.00 0.67 O ATOM 1966 O5' DC C 126 12.421 -11.483 -6.501 1.00 0.64 O ATOM 1967 C5' DC C 126 12.809 -11.156 -5.162 1.00 0.71 C ATOM 1968 C4' DC C 126 12.549 -12.317 -4.196 1.00 0.73 C ATOM 1969 O4' DC C 126 11.160 -12.337 -3.795 1.00 0.71 O ATOM 1970 C3' DC C 126 12.886 -13.679 -4.817 1.00 0.79 C ATOM 1971 O3' DC C 126 13.987 -14.285 -4.137 1.00 0.89 O ATOM 1972 C2' DC C 126 11.636 -14.522 -4.659 1.00 0.80 C ATOM 1973 C1' DC C 126 10.616 -13.668 -3.911 1.00 0.74 C ATOM 1974 N1 DC C 126 9.320 -13.644 -4.638 1.00 0.68 N ATOM 1975 C2 DC C 126 8.214 -14.250 -4.048 1.00 0.79 C ATOM 1976 O2 DC C 126 8.323 -14.785 -2.947 1.00 0.98 O ATOM 1977 N3 DC C 126 7.029 -14.231 -4.720 1.00 0.77 N ATOM 1978 C4 DC C 126 6.931 -13.642 -5.919 1.00 0.64 C ATOM 1979 N4 DC C 126 5.757 -13.635 -6.553 1.00 0.64 N ATOM 1980 C5 DC C 126 8.065 -13.019 -6.527 1.00 0.63 C ATOM 1981 C6 DC C 126 9.232 -13.044 -5.853 1.00 0.65 C ATOM 1982 H5' DC C 126 12.244 -10.285 -4.831 1.00 0.77 H ATOM 1983 H5'' DC C 126 13.873 -10.914 -5.148 1.00 0.77 H ATOM 1984 H4' DC C 126 13.165 -12.177 -3.307 1.00 0.78 H ATOM 1985 H3' DC C 126 13.131 -13.571 -5.879 1.00 0.79 H ATOM 1986 HO3' DC C 126 14.083 -13.838 -3.293 1.00 1.15 H ATOM 1987 H2' DC C 126 11.237 -14.799 -5.638 1.00 0.80 H ATOM 1988 H2'' DC C 126 11.869 -15.424 -4.089 1.00 0.90 H ATOM 1989 H1' DC C 126 10.472 -14.071 -2.909 1.00 0.82 H ATOM 1990 H41 DC C 126 4.951 -14.072 -6.130 1.00 0.74 H ATOM 1991 H42 DC C 126 5.674 -13.192 -7.456 1.00 0.63 H ATOM 1992 H5 DC C 126 7.988 -12.543 -7.504 1.00 0.71 H ATOM 1993 H6 DC C 126 10.117 -12.581 -6.281 1.00 0.74 H TER 1994 DC C 126 MASTER 142 0 0 1 3 0 0 6 1991 3 0 8 END